﻿id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
15094	Crash in garbage collection	chimerax-bug-report@…	Eric Pettersen	"{{{
The following bug report has been submitted:
Platform:        macOS-14.4.1-x86_64-i386-64bit
ChimeraX Version: 1.7.1 (2024-01-23 01:58:08 UTC)
Description
Last time you used ChimeraX it crashed.
Please describe steps that led to the crash here.
Fatal Python error: Segmentation fault

Current thread 0x00007ff84c382100 (most recent call first):
  Garbage-collecting
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/molobject.py"", line 2000 in save_state
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/structure.py"", line 219 in take_snapshot
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/structure.py"", line 1417 in take_snapshot
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/session.py"", line 296 in process
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/session.py"", line 273 in discovery
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/session.py"", line 636 in save
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/session.py"", line 912 in save
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core_formats/__init__.py"", line 95 in save
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/save_command/cmd.py"", line 101 in provider_save
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 2908 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/save_command/cmd.py"", line 86 in cmd_save
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py"", line 2908 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/run.py"", line 49 in run
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/save_command/dialog.py"", line 62 in display
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/save_command/dialog.py"", line 138 in show_save_file_dialog
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/save_command/dialog.py"", line 127 in 
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py"", line 275 in event_loop
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 918 in init
  File ""/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 1069 in 
  File """", line 88 in _run_code
  File """", line 198 in _run_module_as_main

Extension modules: chimerax.arrays._arrays, numpy.core._multiarray_umath, numpy.core._multiarray_tests, numpy.linalg._umath_linalg, numpy.fft._pocketfft_internal, numpy.random._common, numpy.random.bit_generator, numpy.random._bounded_integers, numpy.random._mt19937, numpy.random.mtrand, numpy.random._philox, numpy.random._pcg64, numpy.random._sfc64, numpy.random._generator, chimerax.geometry._geometry, PyQt6.QtCore, PyQt6.QtGui, PyQt6.QtWidgets, PyQt6.QtWebChannel, PyQt6.QtNetwork, PyQt6.QtWebEngineCore, PyQt6.QtPrintSupport, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.map._map, chimerax.surface._surface, charset_normalizer.md, PIL._imaging, matplotlib._c_internal_utils, matplotlib._path, kiwisolver._cext, matplotlib._image, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.pdb_lib._load_libs, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, PIL._imagingmath, chimerax.segment._segment, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.pdb._pdbio, chimerax.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize, numpy.linalg.lapack_lite (total: 62)


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    ""size"" : 196608,
    ""uuid"" : ""c1616b8c-e517-3843-9946-07100812a3fa"",
    ""path"" : ""\/Applications\/ChimeraX-1.7.1.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.11\/lib\/python3.11\/lib-dynload\/_lzma.cpython-311-darwin.so"",
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    ""path"" : ""\/Applications\/ChimeraX-1.7.1.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.11\/lib\/python3.11\/lib-dynload\/_bz2.cpython-311-darwin.so"",
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    ""path"" : ""\/Applications\/ChimeraX-1.7.1.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.11\/lib\/python3.11\/lib-dynload\/zlib.cpython-311-darwin.so"",
    ""name"" : ""zlib.cpython-311-darwin.so""
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    ""size"" : 16384,
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    ""path"" : ""\/Applications\/ChimeraX-1.7.1.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.11\/lib\/python3.11\/lib-dynload\/_datetime.cpython-311-darwin.so"",
    ""name"" : ""_datetime.cpython-311-darwin.so""
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    ""path"" : ""\/Applications\/ChimeraX-1.7.1.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.11\/lib\/python3.11\/lib-dynload\/math.cpython-311-darwin.so"",
    ""name"" : ""math.cpython-311-darwin.so""
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===== Log before crash start =====
Startup Messages  
---  
note | available bundle cache has not been initialized yet  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P388_J125_003_volume_map.mrc

Opened cryosparc_P388_J125_003_volume_map.mrc as #1, grid size 180,180,180,
pixel 2.85, shown at level 0.612, step 1, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P388_J181_002_volume_map.mrc

Opened cryosparc_P388_J181_002_volume_map.mrc as #2, grid size 180,180,180,
pixel 2.85, shown at level 0.614, step 1, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P388_J182_002_volume_map.mrc

Opened cryosparc_P388_J182_002_volume_map.mrc as #3, grid size 180,180,180,
pixel 2.85, shown at level 0.611, step 1, values float32  

> hide #!2 models

> hide #!3 models

> volume #1 level 0.5077

> volume #1 level 0.4

> volume #1 level 0.45

> volume #2 level 0.45

> volume #1 level 0.4

> volume #1 level 0.45

> volume #2 level 0.4

> volume #3 level 0.4

> volume #3 level 0.45

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P310_J405_007_volume_map.mrc

Opened cryosparc_P310_J405_007_volume_map.mrc as #4, grid size 640,640,640,
pixel 0.95, shown at level 0.114, step 4, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P310_J408_007_volume_map.mrc

Opened cryosparc_P310_J408_007_volume_map.mrc as #5, grid size 640,640,640,
pixel 0.95, shown at level 0.111, step 4, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P310_J413_009_volume_map.mrc

Opened cryosparc_P310_J413_009_volume_map.mrc as #6, grid size 640,640,640,
pixel 0.95, shown at level 0.114, step 4, values float32  

> hide #!3 models

> hide #!5 models

> hide #!6 models

> volume #4 step 1

> volume #4 level 0.1

> volume #4 level 0.12

> volume #5 step 1

> volume #5 level 0.12

> volume #4 level 0.1

> volume #4 level 0.12

> volume #5 level 0.1

> volume #6 step 1

> volume #6 level 0.12

> show #!6 models

> hide #!6 models

> show #!5 models

> hide #!5 models

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J408_008_volume_map.mrc

Opened cryosparc_P17_J408_008_volume_map.mrc as #7, grid size 294,294,294,
pixel 1.9, shown at level 0.354, step 2, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J368_007_volume_map.mrc

Opened cryosparc_P17_J368_007_volume_map.mrc as #8, grid size 294,294,294,
pixel 1.9, shown at level 0.37, step 2, values float32  

> hide #!8 models

> hide #!7 models

> show #!8 models

> volume #8 step 1

> volume #8 level 0.4191

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J408_008_volume_map.mrc

Opened cryosparc_P17_J408_008_volume_map.mrc as #9, grid size 294,294,294,
pixel 1.9, shown at level 0.354, step 2, values float32  

> close #9

> show #!7 models

> hide #!7 models

> volume #8 level 0.4

> volume #7 step 1

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J392_002_volume_map.mrc

Opened cryosparc_P17_J392_002_volume_map.mrc as #9, grid size 294,294,294,
pixel 1.9, shown at level 0.207, step 2, values float32  

> hide #!7 models

> volume #9 step 1

> volume #9 level 0.3788

> volume #9 level 0.4816

> hide #!9 models

> show #!9 models

> show #!8 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!9 models

> show #!9 models

> hide #!8 models

> show #!8 models

> hide #!9 models

> hide #!8 models

> show #!9 models

> hide #!9 models

> show #!9 models

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J411_002_volume_map.mrc

Opened cryosparc_P17_J411_002_volume_map.mrc as #10, grid size 294,294,294,
pixel 1.9, shown at level 0.214, step 2, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J412_002_volume_map.mrc

Opened cryosparc_P17_J412_002_volume_map.mrc as #11, grid size 294,294,294,
pixel 1.9, shown at level 0.289, step 2, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J413_002_volume_map.mrc

Opened cryosparc_P17_J413_002_volume_map.mrc as #12, grid size 294,294,294,
pixel 1.9, shown at level 0.214, step 2, values float32  

> volume #10 step 1

> volume #11 step 1

> volume #12 step 1

> volume #10 level 0.5137

> volume #10 level 0.4337

> volume #12 level 0.4965

> volume #12 level 0.4561

> hide #!9 models

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J401_007_volume_map.mrc

Opened cryosparc_P17_J401_007_volume_map.mrc as #13, grid size 294,294,294,
pixel 1.9, shown at level 0.357, step 2, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J403_008_volume_map.mrc

Opened cryosparc_P17_J403_008_volume_map.mrc as #14, grid size 294,294,294,
pixel 1.9, shown at level 0.357, step 2, values float32  

> show #!8 models

> hide #!8 models

> volume #13 step 1

> volume #14 step 1

> volume #13 level 0.35

> volume #13 level 0.3

> volume #14 level 0.3

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J399_007_volume_map.mrc

Opened cryosparc_P17_J399_007_volume_map.mrc as #15, grid size 294,294,294,
pixel 1.9, shown at level 0.357, step 2, values float32  

> hide #!14 models

> volume #15 step 1

> volume #15 level 0.2842

> volume #15 level 0.2923

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P388_J217_006_volume_map.mrc

Opened cryosparc_P388_J217_006_volume_map.mrc as #16, grid size 294,294,294,
pixel 1.9, shown at level 0.368, step 2, values float32  

> hide #!15 models

> volume #16 step 1

> volume #16 level 0.3641

> show #!8 models

> volume #16 level 0.4

> hide #!8 models

> show #!8 models

> hide #!8 models

> show #!8 models

> hide #!8 models

> show #!8 models

> open /Users/cvetkom/Downloads/cs_P17_J486_009_volume_map.mrc

Opened cs_P17_J486_009_volume_map.mrc as #17, grid size 588,588,588, pixel
0.85, shown at level 0.169, step 4, values float32  

> open /Users/cvetkom/Downloads/cryosparc_P17_J486_005_volume_map.mrc

Opened cryosparc_P17_J486_005_volume_map.mrc as #18, grid size 588,588,588,
pixel 0.85, shown at level 0.169, step 4, values float32  

> hide #!8 models

> hide #!16 models

> volume #18 step 1

> volume #17 step 1

> volume #17 level 0.1385

> volume #17 level 0.1646

> volume #17 level 0.1556

> ui tool show ""Map Coordinates""

> save /Users/cvetkom/Downloads/cs_P17_J486_009_volume_map.mrc models #17

> hide #!17 models

> show #!18 models

> hide #!18 models

> show #!18 models

> hide #!18 models

> show #!18 models

> hide #!18 models

> close #18

> open /Users/cvetkom/Downloads/cryosparc_P17_J491_011_volume_map.mrc

Opened cryosparc_P17_J491_011_volume_map.mrc as #18, grid size 588,588,588,
pixel 0.85, shown at level 0.166, step 4, values float32  

> open /Users/cvetkom/Downloads/cryosparc_P17_J492_012_volume_map.mrc

Opened cryosparc_P17_J492_012_volume_map.mrc as #19, grid size 588,588,588,
pixel 0.85, shown at level 0.166, step 4, values float32  

> volume #18 step 1

> volume #18 level 0.139

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/initial_model_job502.mrc

Opened initial_model_job502.mrc as #20, grid size 588,588,588, pixel 0.95,
shown at level 0.00493, step 4, values float32  

> hide #!18 models

> volume #20 step 1

> volume #20 level 0.005154

> volume #20 level 0.00473

> close #20

> show #!8 models

> open /Users/cvetkom/Downloads/cryosparc_P17_J429_map_sharp.mrc

Opened cryosparc_P17_J429_map_sharp.mrc as #20, grid size 294,294,294, pixel
1.9, shown at level 0.000158, step 2, values float32  

> hide #!8 models

> volume #20 step 1

> volume #20 level 0.123

> volume #20 level 0.1118

> hide #!20 models

> show #!18 models

> show #!19 models

> hide #!18 models

> volume #19 step 1

> volume #19 level 0.1482

> show #!18 models

> hide #!18 models

> volume #18 level 0.14

> volume #19 level 0.14

> volume #18 level 0.135

> volume #18 level 0.13

> volume #19 level 0.13

> open /Users/cvetkom/Downloads/cryosparc_P17_J489_013_volume_map.mrc

Opened cryosparc_P17_J489_013_volume_map.mrc as #21, grid size 588,588,588,
pixel 0.85, shown at level 0.165, step 4, values float32  

> hide #!21 models

> show #!18 models

> hide #!19 models

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> show #!18 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> show #!18 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> hide #!19 models

> show #!21 models

> volume #21 step 1

> volume #21 level 0.14

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!21 models

> show #!20 models

> hide #!20 models

> show #!20 models

> hide #!20 models

> show #!20 models

> hide #!20 models

> show #!21 models

> hide #!21 models

> hide #!19 models

> show #!19 models

> hide #!19 models

> show #!20 models

> hide #!20 models

> show #!20 models

> close #18-21

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J491_011_volume_map.mrc

Opened cryosparc_P17_J491_011_volume_map.mrc as #18, grid size 588,588,588,
pixel 0.85, shown at level 0.166, step 4, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J489_013_volume_map.mrc

Opened cryosparc_P17_J489_013_volume_map.mrc as #19, grid size 588,588,588,
pixel 0.85, shown at level 0.165, step 4, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J492_012_volume_map.mrc

Opened cryosparc_P17_J492_012_volume_map.mrc as #20, grid size 588,588,588,
pixel 0.85, shown at level 0.166, step 4, values float32  

> volume #18 step 2

> volume #18 step 1

> volume #19 step 1

> volume #20 step 1

> volume #18 level 0.13

> volume #19 level 0.13

> volume #20 level 0.13

> hide #!18 models

> show #!19 models

> hide #!19 models

> show #!20 models

> hide #!20 models

> show #!18 models

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> show #!18 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> show #!18 models

> hide #!19 models

> show #!19 models

> hide #!18 models

> show #!18 models

> hide #!18 models

> show #!18 models

> hide #!19 models

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/postprocess_masked_job511.mrc

Opened postprocess_masked_job511.mrc as #21, grid size 588,588,588, pixel
0.95, shown at level 0.00498, step 4, values float32  

> hide #!18 models

> show #!18 models

> hide #!18 models

> hide #!21 models

> show #!18 models

> select add #21

2 models selected  

> show #!21 models

> ui mousemode right ""rotate selected models""

> view matrix models
> #21,-0.55287,0.83087,-0.063182,166.89,-0.5876,-0.33499,0.73655,276.93,0.59081,0.44434,0.67343,-162.06

> ui mousemode right ""translate selected models""

> view matrix models
> #21,-0.55287,0.83087,-0.063182,188.59,-0.5876,-0.33499,0.73655,291.89,0.59081,0.44434,0.67343,-218.35

> view matrix models
> #21,-0.55287,0.83087,-0.063182,185.39,-0.5876,-0.33499,0.73655,288.19,0.59081,0.44434,0.67343,-212.32

> ui mousemode right zoom

> select subtract #21

Nothing selected  

> ui tool show ""Fit in Map""

> fitmap #21 inMap #18

Fit map postprocess_masked_job511.mrc in map
cryosparc_P17_J491_011_volume_map.mrc using 31756 points  
correlation = 0.8968, correlation about mean = 0.2434, overlap = 42.45  
steps = 180, shift = 7, angle = 10.3 degrees  
  
Position of postprocess_masked_job511.mrc (#21) relative to
cryosparc_P17_J491_011_volume_map.mrc (#18) coordinates:  
Matrix rotation and translation  
-0.51920954 0.84749667 0.11032156 127.58974848  
-0.54899809 -0.42966309 0.71693147 315.34926138  
0.65499813 0.31167134 0.68835923 -196.84626713  
Axis -0.26099112 -0.35077655 -0.89935502  
Axis point 178.92637046 159.99291122 0.00000000  
Rotation angle (degrees) 129.06906427  
Shift along axis 33.11776092  
  

> hide #!18 models

> volume #21 step 1

> volume #21 level 0.005527

> hide #!21 models

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job505_run_class001.mrc

Opened Ref3D_job505_run_class001.mrc as #22, grid size 588,588,588, pixel
0.95, shown at level 0.005, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job507_run_class001.mrc

Opened Ref3D_job507_run_class001.mrc as #23, grid size 588,588,588, pixel
0.95, shown at level 0.00501, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job505_run_class001.mrc

Opened Ref3D_job505_run_class001.mrc as #24, grid size 588,588,588, pixel
0.95, shown at level 0.005, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job507_run_class001.mrc

Opened Ref3D_job507_run_class001.mrc as #25, grid size 588,588,588, pixel
0.95, shown at level 0.00501, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job508_run_class001.mrc

Opened Ref3D_job508_run_class001.mrc as #26, grid size 588,588,588, pixel
0.95, shown at level 0.00502, step 4, values float32  

> hide #!26 models

> hide #!25 models

> hide #!24 models

> hide #!23 models

> hide #!22 models

> show #!22 models

> hide #!22 models

> close #22-26

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job505_run_class001.mrc

Opened Ref3D_job505_run_class001.mrc as #22, grid size 588,588,588, pixel
0.95, shown at level 0.005, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job506_run_class001.mrc

Opened Ref3D_job506_run_class001.mrc as #23, grid size 588,588,588, pixel
0.95, shown at level 0.00502, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job507_run_class001.mrc

Opened Ref3D_job507_run_class001.mrc as #24, grid size 588,588,588, pixel
0.95, shown at level 0.00501, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job508_run_class001.mrc

Opened Ref3D_job508_run_class001.mrc as #25, grid size 588,588,588, pixel
0.95, shown at level 0.00502, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job509_run_class001.mrc

Opened Ref3D_job509_run_class001.mrc as #26, grid size 588,588,588, pixel
0.95, shown at level 0.005, step 4, values float32  

> hide #!23 models

> hide #!24 models

> hide #!25 models

> hide #!26 models

> volume #22 step 1

> volume #22 level 0.004523

> volume #22 level 0.004

> volume #23 step 1

> volume #23 level 0.004

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/postprocess_masked_job514.mrc

Opened postprocess_masked_job514.mrc as #27, grid size 588,588,588, pixel
0.95, shown at level 0.00499, step 4, values float32  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/postprocess_masked_job515.mrc

Opened postprocess_masked_job515.mrc as #28, grid size 588,588,588, pixel
0.95, shown at level 0.00499, step 4, values float32  

> hide #!27 models

> hide #!28 models

> hide #!22 models

> hide #!23 models

> show #!24 models

> show #!22 models

> hide #!22 models

> volume #24 step 1

> volume #24 level 0.004649

> show #!25 models

> hide #!24 models

> show #!24 models

> hide #!24 models

> show #!26 models

> hide #!25 models

> hide #!26 models

> show #!22 models

> hide #!22 models

> show #!23 models

> hide #!23 models

> show #!24 models

> show #!25 models

> volume #25 step 1

> volume #24 level 0.0045

> volume #24 level 0.0046

> hide #!24 models

> volume #25 level 0.0046

> show #!24 models

> hide #!25 models

> show #!25 models

> hide #!25 models

> show #!25 models

> hide #!25 models

> hide #!24 models

> show #!27 models

> show #!21 models

> hide #!21 models

> volume #27 step 1

> volume #27 level 0.00489

> volume #28 step 1

> show #!27 models

> hide #!28 models

> show #!28 models

> hide #!27 models

> hide #!28 models

> show #!23 models

> volume #23 level 0.0035

> volume #23 level 0.0045

> ui tool show ""Segment Map""

Segmenting Ref3D_job506_run_class001.mrc, density threshold 0.004500  
Only showing 60 of 67 regions.  
Showing 60 of 67 region surfaces  
277 watershed regions, grouped to 67 regions  
Showing Ref3D_job506_run_class001.seg - 67 regions, 60 surfaces  

> select #29.26

1 model selected  

> select add #29.13

2 models selected  

> select add #29.6

3 models selected  

> select add #29.1

4 models selected  

> select add #29.38

5 models selected  
Grouped 5 regions  

> select add #29.11

2 models selected  

> select add #29.31

3 models selected  
Grouped 3 regions  

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

> hide #!23 models

> show #!23 models

Only showing 60 of 61 regions.  
Showing 60 of 61 region surfaces  
Only showing 60 of 61 regions.  
Showing 60 of 61 region surfaces  
Opened Ref3D_job506_run_class001_imasked as #30, grid size 588,588,588, pixel
0.95, shown at step 1, values float32  

> hide #!23 models

> hide #!29 models

> show #!29 models

> hide #!30 models

> show #!30 models

> hide #!29 models

> show #!29 models

> hide #!30 models

Only showing 60 of 61 regions.  
Showing 60 of 61 region surfaces  

> show #!30 models

> hide #!29 models

> show #!29 models

> hide #!30 models

> show #!30 models

> hide #!30 models

> show #!30 models

> hide #!30 models

> hide #!29 models

> select add #29

61 models selected  

> select subtract #29

Nothing selected  

> show #!30 models

> ui tool show ""Map Eraser""

> volume erase #30 center 322.28,330.54,256.92 radius 31.628

> hide #!30 models

> show #!30 models

> save
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/Ref3D_job506_run_class001_NCP.mrc
> models #30

> volume #30 level 0.004

> volume #30 level 0.0045

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J288_006_volume_map.mrc

Opened cryosparc_P17_J288_006_volume_map.mrc as #31, grid size 294,294,294,
pixel 1.9, shown at level 0.258, step 2, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J288_006_volume_map_sharp.mrc

Opened cryosparc_P17_J288_006_volume_map_sharp.mrc as #32, grid size
294,294,294, pixel 1.9, shown at level 0.251, step 2, values float32  

> volume #32 step 1

> volume #32 level 0.5717

> volume #31 step 1

> volume #31 level 0.6543

> open 4C93 fromDatabase pdb format mmcif

Summary of feedback from opening 4C93 fetched from pdb  
---  
note | Fetching compressed mmCIF 4c93 from
http://files.rcsb.org/download/4c93.cif  
  
4c93 title:  
Crystal structure of the carboxy-terminal domain of yeast Ctf4 bound to Pol
alpha. [more info...]  
  
Chain information for 4c93 #33  
---  
Chain | Description | UniProt  
A B C | DNA POLYMERASE ALPHA-BINDING PROTEIN | CTF4_YEAST 471-927  
D E | DNA POLYMERASE ALPHA CATALYTIC SUBUNIT A | DPOA_YEAST 137-149  
  

> select add #33

9593 atoms, 9682 bonds, 4 pseudobonds, 1331 residues, 2 models selected  

> hide (#!33 & sel) target a

> cartoon (#!33 & sel)

> select subtract #33

Nothing selected  

> select add #33

9593 atoms, 9682 bonds, 4 pseudobonds, 1331 residues, 2 models selected  

> ui mousemode right ""translate selected models""

> view matrix models #33,1,0,0,277.71,0,1,0,277.7,0,0,1,412.4

> ui mousemode right ""rotate selected models""

> view matrix models
> #33,0.85071,0.51833,-0.087371,264.2,-0.5256,0.83678,-0.15343,265.2,-0.0064157,0.17644,0.98429,409.11

> ui mousemode right ""translate selected models""

> view matrix models
> #33,0.85071,0.51833,-0.087371,206.06,-0.5256,0.83678,-0.15343,295.57,-0.0064157,0.17644,0.98429,358

> ui mousemode right ""rotate selected models""

> view matrix models
> #33,0.85087,0.50579,-0.1421,203.77,-0.52472,0.80474,-0.2776,290.42,-0.026051,0.31077,0.95013,354.26

> view matrix models
> #33,0.74237,0.64892,-0.16668,199.01,-0.66761,0.73743,-0.10249,297.15,0.056405,0.18736,0.98067,358.62

> view matrix models
> #33,0.61879,0.74677,-0.24378,192.29,-0.78542,0.59391,-0.17432,294.16,0.014612,0.29934,0.95404,355.21

> view matrix models
> #33,0.9983,-0.034334,-0.047129,217.9,0.018839,0.95483,-0.29655,295.6,0.055182,0.29515,0.95386,355.87

> view matrix models
> #33,0.9358,0.25827,-0.23996,204.12,-0.34616,0.80203,-0.48675,283.69,0.066739,0.53856,0.83994,347.46

> view matrix models
> #33,0.4441,-0.059162,-0.89402,171.67,-0.18738,0.96962,-0.15725,298.59,0.87616,0.23736,0.41953,344.85

> view matrix models
> #33,0.35501,0.67532,-0.64646,171.15,-0.35267,0.73716,0.57639,332.55,0.86579,0.023365,0.49987,351.35

> ui mousemode right ""translate selected models""

> view matrix models
> #33,0.35501,0.67532,-0.64646,241,-0.35267,0.73716,0.57639,296.24,0.86579,0.023365,0.49987,410.46

> fitmap #33 inMap #31

Fit molecule 4c93 (#33) to map cryosparc_P17_J288_006_volume_map.mrc (#31)
using 9593 atoms  
average map value = 0.5941, steps = 164  
shifted from previous position = 8.43  
rotated from previous position = 36.7 degrees  
atoms outside contour = 5817, contour level = 0.65427  
  
Position of 4c93 (#33) relative to cryosparc_P17_J288_006_volume_map.mrc (#31)
coordinates:  
Matrix rotation and translation  
-0.11641260 0.77432829 -0.62198377 234.06062084  
-0.72447465 0.36217880 0.58648359 303.04623599  
0.67940017 0.51888555 0.51881904 403.24027766  
Axis -0.03403562 -0.65524703 -0.75464753  
Axis point 89.28765412 -151.08833550 0.00000000  
Rotation angle (degrees) 96.75980732  
Shift along axis -510.84082774  
  

> fitmap #33 inMap #31

Fit molecule 4c93 (#33) to map cryosparc_P17_J288_006_volume_map.mrc (#31)
using 9593 atoms  
average map value = 0.5941, steps = 40  
shifted from previous position = 0.00237  
rotated from previous position = 0.00559 degrees  
atoms outside contour = 5819, contour level = 0.65427  
  
Position of 4c93 (#33) relative to cryosparc_P17_J288_006_volume_map.mrc (#31)
coordinates:  
Matrix rotation and translation  
-0.11649075 0.77431865 -0.62198114 234.06168000  
-0.72442922 0.36216631 0.58654742 303.05097408  
0.67943522 0.51890866 0.51875003 403.23724883  
Axis -0.03405645 -0.65526960 -0.75462700  
Axis point 89.27779010 -151.08286692 0.00000000  
Rotation angle (degrees) 96.76441303  
Shift along axis -510.84511620  
  

> open 6SKL fromDatabase pdb format mmcif

6skl title:  
Cryo-EM structure of the CMG Fork Protection Complex at a replication fork -
Conformation 1 [more info...]  
  
Chain information for 6skl #34  
---  
Chain | Description | UniProt  
2 | DNA replication licensing factor MCM2 | MCM2_YEAST 1-868  
3 | DNA replication licensing factor MCM3 | MCM3_YEAST 1-971  
4 | DNA replication licensing factor MCM4 | MCM4_YEAST 1-933  
5 | Minichromosome maintenance protein 5 | MCM5_YEAST 1-775  
6 | DNA replication licensing factor MCM6 | MCM6_YEAST 1-1017  
7 | DNA replication licensing factor MCM7 | MCM7_YEAST 1-845  
A | DNA replication complex GINS protein PSF1 | PSF1_YEAST 1-208  
B | DNA replication complex GINS protein PSF2 | PSF2_YEAST 1-213  
C | DNA replication complex GINS protein PSF3 | PSF3_YEAST 1-194  
D | DNA replication complex GINS protein SLD5 | SLD5_YEAST 1-294  
E | Cell division control protein 45 | CDC45_YEAST 1-650  
F G H | DNA polymerase alpha-binding protein | CTF4_YEAST 1-927  
I | DNA fork, leading-strand template |  
J | DNA fork, lagging-strand template |  
X | Topoisomerase 1-associated factor 1 | TOF1_YEAST 1-1238  
Y | Chromosome segregation in meiosis protein 3 | CSM3_YEAST 1-317  
  
Non-standard residues in 6skl #34  
---  
ANP — phosphoaminophosphonic acid-adenylate ester  
MG — magnesium ion  
ZN — zinc ion  
  

> select subtract #33

Nothing selected  

> select add #34

118220 atoms, 119405 bonds, 130 pseudobonds, 7321 residues, 4 models selected  

> hide (#!34 & sel) target a

> cartoon (#!34 & sel)

> view matrix models #34,1,0,0,-105.11,0,1,0,63.093,0,0,1,60.805

> ui mousemode right ""rotate selected models""

> view matrix models
> #34,0.89661,0.16888,-0.40936,-42.927,-0.024986,0.94224,0.33399,18.768,0.44212,-0.28923,0.84904,55.571

> view matrix models
> #34,0.18469,0.42907,0.88419,-184.99,-0.91736,-0.24753,0.31174,429.58,0.35262,-0.86869,0.34789,275.52

> view matrix models
> #34,-0.74581,-0.65341,0.12973,345.25,-0.31799,0.17808,-0.93122,453.04,0.58536,-0.73576,-0.34059,328.08

> view matrix models
> #34,-0.74688,-0.65706,0.10221,351.14,-0.29136,0.1852,-0.93852,447.68,0.59773,-0.73074,-0.32976,322.69

> view matrix models
> #34,-0.79277,-0.59486,-0.13289,390.85,-0.15343,0.40576,-0.90101,370.97,0.58989,-0.6939,-0.41295,332.21

> view matrix models
> #34,-0.80975,-0.58676,0.0025381,368.19,-0.2818,0.38509,-0.8788,396.52,0.51467,-0.71233,-0.47718,362.38

> volume #31 level 0.5196

> volume #31 flipNormals

Missing ""flipNormals"" keyword's argument  

> volume flip #31

Opened cryosparc_P17_J288_006_volume_map.mrc z flip as #35, grid size
294,294,294, pixel 1.9, shown at step 1, values float32  

> select subtract #34

Nothing selected  

> select add #35

2 models selected  

> view matrix models
> #35,0.78895,-0.57985,-0.20332,272.36,0.063773,-0.25184,0.96567,82.546,-0.61114,-0.77483,-0.16171,684.21

> view matrix models
> #35,0.28797,-0.87982,-0.37814,542.26,-0.92038,-0.36335,0.14448,602.17,-0.26451,0.30642,-0.91441,478.11

> view matrix models
> #35,0.19939,-0.94065,-0.27463,557.88,-0.84145,-0.30798,0.44396,488.1,-0.50219,0.14257,-0.85292,575.32

> view matrix models
> #35,0.056907,-0.98144,-0.18311,586.32,-0.81292,-0.15202,0.56218,406.67,-0.57958,0.11686,-0.80649,592.58

> view matrix models
> #35,-0.4142,-0.82661,-0.38098,727.63,-0.85036,0.50069,-0.16185,421.02,0.32454,0.25694,-0.91031,323.5

> view matrix models
> #35,-0.05329,-0.9466,-0.31798,642.33,-0.99846,0.055466,0.0022138,544.59,0.015542,0.31761,-0.94809,404.07

> view matrix models
> #35,-0.12565,-0.99206,-0.005759,595.9,-0.98907,0.12572,-0.077001,542.65,0.077114,-0.003979,-0.99701,488.13

> view matrix models
> #35,-0.028832,-0.99711,0.070342,550.41,-0.98983,0.038289,0.13704,512.53,-0.13933,-0.065675,-0.98807,564.4

> ui mousemode right ""translate selected models""

> view matrix models
> #35,-0.028832,-0.99711,0.070342,558.82,-0.98983,0.038289,0.13704,502.05,-0.13933,-0.065675,-0.98807,609.85

> select subtract #35

Nothing selected  

> fitmap #33 inMap #35

Fit molecule 4c93 (#33) to map cryosparc_P17_J288_006_volume_map.mrc z flip
(#35) using 9593 atoms  
average map value = 0.748, steps = 156  
shifted from previous position = 23.9  
rotated from previous position = 52.9 degrees  
atoms outside contour = 2729, contour level = 0.51963  
  
Position of 4c93 (#33) relative to cryosparc_P17_J288_006_volume_map.mrc z
flip (#35) coordinates:  
Matrix rotation and translation  
0.31609082 -0.94869655 0.00783922 290.47366164  
-0.57784462 -0.18596222 0.79467833 322.70855084  
-0.75245079 -0.25572037 -0.60698014 144.58037287  
Axis -0.77884069 0.56373337 0.27497613  
Axis point 0.00000000 302.79412564 42.56571290  
Rotation angle (degrees) 137.59748776  
Shift along axis -4.55497724  
  

> volume #35 color #ffffb280

> volume #35 color #ffffb29a

> ui tool show Matchmaker

QDockWidget failed to find relevant screen info. screenFrom:
QScreen(0x600001698de0, name=""DELL U2415"") screenTo: QScreen(0x0) wdgScreen:
QScreen(0x6000016ad580, name=""Built-in Retina Display"") orgWdgScreen
QScreen(0x6000016ad580, name=""Built-in Retina Display"")  

QDockWidget failed to find relevant screen info. screenFrom:
QScreen(0x600001698de0, name=""DELL U2415"") screenTo: QScreen(0x0) wdgScreen:
QScreen(0x600001698de0, name=""DELL U2415"") orgWdgScreen
QScreen(0x6000016ad580, name=""Built-in Retina Display"")  

> matchmaker #33/A to #34/G pairing ss

Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker 6skl, chain G (#34) with 4c93, chain A (#33), sequence alignment
score = 2250.7  
RMSD between 395 pruned atom pairs is 0.975 angstroms; (across all 421 pairs:
1.137)  
  

> select add #33

9593 atoms, 9682 bonds, 4 pseudobonds, 1331 residues, 2 models selected  

> select add #34

127813 atoms, 129087 bonds, 134 pseudobonds, 8652 residues, 6 models selected  

> view matrix models
> #33,0.20694,0.33166,-0.92042,219.01,-0.50314,0.84292,0.19061,241.4,0.83906,0.42366,0.3413,390.93,#34,-0.80975,-0.58676,0.0025381,554.75,-0.2818,0.38509,-0.8788,387.59,0.51467,-0.71233,-0.47718,400.46

> view matrix models
> #33,0.20694,0.33166,-0.92042,219.86,-0.50314,0.84292,0.19061,243.18,0.83906,0.42366,0.3413,387.91,#34,-0.80975,-0.58676,0.0025381,555.6,-0.2818,0.38509,-0.8788,389.37,0.51467,-0.71233,-0.47718,397.44

> select subtract #34

9593 atoms, 9682 bonds, 4 pseudobonds, 1331 residues, 2 models selected  

> select subtract #33

Nothing selected  

> fitmap #34 inMap #35

Fit molecule 6skl (#34) to map cryosparc_P17_J288_006_volume_map.mrc z flip
(#35) using 118220 atoms  
average map value = 0.6269, steps = 156  
shifted from previous position = 29.5  
rotated from previous position = 20.7 degrees  
atoms outside contour = 51602, contour level = 0.51963  
  
Position of 6skl (#34) relative to cryosparc_P17_J288_006_volume_map.mrc z
flip (#35) coordinates:  
Matrix rotation and translation  
0.46209162 -0.10482145 0.88061558 50.05829992  
0.51912918 0.83705154 -0.17277039 61.05331656  
-0.71901059 0.53698899 0.44121038 233.04243695  
Axis 0.38201772 0.86097564 0.33583240  
Axis point 167.96409560 0.00000000 110.80343384  
Rotation angle (degrees) 68.27348026  
Shift along axis 149.95177710  
  

> matchmaker #33/A to #34/G pairing ss

Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker 6skl, chain G (#34) with 4c93, chain A (#33), sequence alignment
score = 2250.7  
RMSD between 395 pruned atom pairs is 0.975 angstroms; (across all 421 pairs:
1.137)  
  

> ui mousemode right zoom

> hide #!35 models

> open ""/Users/cvetkom/Downloads/ranked_0 (1).pdb""

Chain information for ranked_0 (1).pdb #36  
---  
Chain | Description  
A | No description available  
B C D | No description available  
  

> matchmaker #36/B to #34/H pairing ss

Parameters  
---  
Chain pairing | ss  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker 6skl, chain H (#34) with ranked_0 (1).pdb, chain B (#36), sequence
alignment score = 2258.6  
RMSD between 415 pruned atom pairs is 0.607 angstroms; (across all 425 pairs:
0.788)  
  

> show #!35 models

> select #36/B

7269 atoms, 7356 bonds, 457 residues, 1 model selected  

> select clear

> select #36/A

277 atoms, 276 bonds, 17 residues, 1 model selected  

> color sel red

> select clear

> show #!32 models

> hide #!32 models

> show #!32 models

> hide #!32 models

> open 8B9D fromDatabase pdb format mmcif

files.rcsb.org failed to respond  

> open 8B9D fromDatabase pdb format mmcif

files.rcsb.org failed to respond  

> open 8B9D fromDatabase pdb format mmcif

Summary of feedback from opening 8B9D fetched from pdb  
---  
warnings | Atom H1 is not in the residue template for MET /C:1  
Atom H1 is not in the residue template for MET /D:1  
Atom H1 is not in the residue template for MET /E:1  
Atom H1 is not in the residue template for MET /P:1  
note | Fetching compressed mmCIF 8b9d from
http://files.rcsb.org/download/8b9d.cif  
  
8b9d title:  
Human replisome bound by Pol α [more info...]  
  
Chain information for 8b9d #37  
---  
Chain | Description | UniProt  
2 | DNA replication licensing factor MCM2 | MCM2_HUMAN 1-904  
3 | DNA replication licensing factor MCM3 | MCM3_HUMAN 1-808  
4 | DNA replication licensing factor MCM4 | MCM4_HUMAN 1-863  
5 | DNA replication licensing factor MCM5 | MCM5_HUMAN 1-734  
6 | DNA replication licensing factor MCM6 | MCM6_HUMAN 1-821  
7 | DNA replication licensing factor MCM7 | MCM7_HUMAN 1-719  
A | DNA polymerase alpha subunit B | DPOA2_HUMAN 1-598  
B | DNA polymerase alpha catalytic subunit | DPOLA_HUMAN 1-1462  
C | Cell division control protein 45 homolog | CDC45_HUMAN 1-134 135-566  
D | DNA replication complex GINS protein PSF1 | PSF1_HUMAN 1-196  
E | DNA replication complex GINS protein PSF2 | PSF2_HUMAN 1-185  
F | DNA replication complex GINS protein PSF3 | PSF3_HUMAN 1-216  
G | DNA replication complex GINS protein SLD5 | SLD5_HUMAN 1-223  
H I J | WD repeat and HMG-box DNA-binding protein 1 | WDHD1_HUMAN 1-1129  
K | Protein timeless homolog | TIM_HUMAN 1-1208  
L | TIMELESS-interacting protein | TIPIN_HUMAN 1-301  
M | Leading strand DNA |  
N | DNA Molecule |  
O | DNA primase small subunit | PRI1_HUMAN 1-420  
P | DNA primase large subunit | PRI2_HUMAN 1-509  
Q | Claspin | CLSPN_HUMAN 1-1339  
  
Non-standard residues in 8b9d #37  
---  
ANP — phosphoaminophosphonic acid-adenylate ester  
MG — magnesium ion  
ZN — zinc ion  
  

> hide #33-37 target a

> cartoon #33-37

> hide #!37 models

> hide #!35 models

> show #!35 models

> save
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J288_006_volume_map_zflip.mrc
> models #35

> hide #36 models

> hide #!35 models

> hide #!34 models

> hide #!33 models

> show #!31 models

> show #!32 models

> hide #!31 models

> show #!31 models

> hide #!31 models

> show #!31 models

> hide #!31 models

> volume #32 level 0.7272

> volume flip #32

Opened cryosparc_P17_J288_006_volume_map_sharp.mrc z flip as #38, grid size
294,294,294, pixel 1.9, shown at step 1, values float32  

> volume #32 level 0.7618

> volume #38 level 0.7618

> volume #38 level 0.7272

> save
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J288_006_volume_map_sharp_zflip.mrc
> models #38

> hide #!38 models

> show #!34 models

> select #34/E

9129 atoms, 9213 bonds, 4 pseudobonds, 564 residues, 2 models selected  

> hide #!34 models

> select add #34

118220 atoms, 119405 bonds, 130 pseudobonds, 7321 residues, 4 models selected  

> select subtract #34

Nothing selected  

> show #!31 models

> hide #!31 models

> show #!19 models

> show #!27 models

> hide #!27 models

> hide #!19 models

> open
> /Users/cvetkom/Documents/AlphaFold/yMrc1_H3H4_tetr/yMrc1_H3H4_tetr_ranked_0.pdb

Chain information for yMrc1_H3H4_tetr_ranked_0.pdb #39  
---  
Chain | Description  
A | No description available  
B C | No description available  
D E | No description available  
  

> select add #39

25142 atoms, 25299 bonds, 1574 residues, 1 model selected  

> view sel

> select subtract #39

Nothing selected  

> hide #39 models

> show #39 models

> hide #39 target a

> cartoon #39

> ui tool show ""Show Sequence Viewer""

> sequence chain #39/A

Alignment identifier is 39/A  

> select #39/A:657

15 atoms, 14 bonds, 1 residue, 1 model selected  

> select #39/A:657-660

63 atoms, 62 bonds, 4 residues, 1 model selected  

> color sel red

> select #39/A:678

15 atoms, 14 bonds, 1 residue, 1 model selected  

> select #39/A:678-712

621 atoms, 621 bonds, 35 residues, 1 model selected  

> select #39/A:746

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #39/A:746-751

96 atoms, 95 bonds, 6 residues, 1 model selected  

> select #39/A:612

15 atoms, 14 bonds, 1 residue, 1 model selected  

> select #39/A:612-616

83 atoms, 83 bonds, 5 residues, 1 model selected  

> select #39/A:746-747

23 atoms, 22 bonds, 2 residues, 1 model selected  

> select #39/A:746-751

96 atoms, 95 bonds, 6 residues, 1 model selected  

> select #39/A:657

15 atoms, 14 bonds, 1 residue, 1 model selected  

> select #39/A:657-660

63 atoms, 62 bonds, 4 residues, 1 model selected  

> open
> /Users/cvetkom/Documents/20240109_CMGC4MCT_Fpl20MN_ATPgS_krios2/mask_job518.mrc

Opened mask_job518.mrc as #40, grid size 588,588,588, pixel 0.95, shown at
level 5e-05, step 4, values float32  

> select add #39

25142 atoms, 25299 bonds, 1574 residues, 1 model selected  

> select subtract #39

Nothing selected  

> hide #39 models

> hide #!40 models

> show #!30 models

> show #!40 models

> hide #!40 models

> show #!40 models

> volume #40 step 1

> volume #40 level 1

> volume #40 color #ffb2b280

> volume #40 level 1

> show #!29 models

> hide #!29 models

> show #!23 models

> hide #!30 models

> hide #!23 models

> hide #!40 models

> show #!30 models

> volume #30 level 0.005

> volume #30 level 0.004

> volume #30 level 0.0045

> volume #30 level 0.005

> show #!40 models

> hide #!40 models

> show #!40 models

> volume #30 level 0.0045

> close #40

> show #39 models

> hide #39 models

> show #!37 models

> hide #!37 models

> close #37

> show #36 models

> hide #36 models

> hide #!30 models

> show #!18 models

> show #!20 models

> hide #!18 models

> show #!19 models

> hide #!20 models

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J492_012_volume_map_sharp.mrc

Opened cryosparc_P17_J492_012_volume_map_sharp.mrc as #37, grid size
588,588,588, pixel 0.85, shown at level 0.161, step 4, values float32  

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J491_011_volume_map_sharp.mrc

Opened cryosparc_P17_J491_011_volume_map_sharp.mrc as #40, grid size
588,588,588, pixel 0.85, shown at level 0.17, step 4, values float32  

> hide #!19 models

> hide #!37 models

> volume #40 level 0.2312

> volume #40 step 1

> volume #40 level 0.3499

> volume #37 level 0.1763

> volume #37 step 1

> volume #37 level 0.2223

> volume #37 level 0.2

> volume #37 level 0.1885

> volume #37 level 0.1742

> hide #!37 models

> show #!8 models

> open
> /Users/cvetkom/Documents/cryoSPARC/cryosparc_P17_J368_007_volume_map_sharp.mrc

Opened cryosparc_P17_J368_007_volume_map_sharp.mrc as #41, grid size
294,294,294, pixel 1.9, shown at level 0.362, step 2, values float32  

> hide #!8 models

> volume #41 step 1

> volume #41 level 0.4564

> hide #!41 models

> show #!35 models

> hide #!35 models

> show #!41 models

> hide #!41 models

> show #!33 models

> hide #!33 models

> show #36 models

> combine #36

> hide #36 models

> show #!41 models

> select add #42

22084 atoms, 22344 bonds, 1388 residues, 1 model selected  

> ui mousemode right ""translate selected models""

> view matrix models
> #42,-0.66651,-0.41454,0.61961,272.25,-0.074937,-0.78968,-0.60893,371.9,0.74172,-0.45229,0.49526,320.86

> ui mousemode right ""rotate selected models""

> view matrix models
> #42,0.88686,0.43938,0.14293,270.28,0.32258,-0.81026,0.4893,369.08,0.3308,-0.38784,-0.86032,324.19

> view matrix models
> #42,0.37114,0.92855,0.0068206,265.93,0.88732,-0.3568,0.29216,367.34,0.27372,-0.10238,-0.95634,322.18

> view matrix models
> #42,-0.31468,0.84864,0.42519,263.78,0.88685,0.10319,0.4504,363.22,0.33835,0.51881,-0.78509,316.9

> view matrix models
> #42,-0.23757,0.91024,0.33914,263.75,0.89188,0.06608,0.44741,363.53,0.38484,0.40877,-0.82753,317.99

> ui mousemode right ""translate selected models""

> view matrix models
> #42,-0.23757,0.91024,0.33914,263.29,0.89188,0.06608,0.44741,364.95,0.38484,0.40877,-0.82753,225.17

> ui tool show ""Fit in Map""

> fitmap #42 inMap #41

Fit molecule copy of ranked_0 (1).pdb (#42) to map
cryosparc_P17_J368_007_volume_map_sharp.mrc (#41) using 22084 atoms  
average map value = 0.6576, steps = 148  
shifted from previous position = 10.7  
rotated from previous position = 27.8 degrees  
atoms outside contour = 5619, contour level = 0.45638  
  
Position of copy of ranked_0 (1).pdb (#42) relative to
cryosparc_P17_J368_007_volume_map_sharp.mrc (#41) coordinates:  
Matrix rotation and translation  
0.11572590 0.95057234 0.28813146 269.08018829  
0.98967501 -0.13504383 0.04802635 358.27183284  
0.08456290 0.27959862 -0.95638576 219.12378513  
Axis 0.74509125 0.65498843 0.12581411  
Axis point 0.00000000 52.42448167 89.73927147  
Rotation angle (degrees) 171.06008584  
Shift along axis 462.72206245  
  

> select subtract #42

Nothing selected  

> color #41 #99bfe584 models

> color #41 #99bfe582 models

> color #41 #99bfe580 models

> volume #41 level 0.5

> volume #41 level 0.55

> save
> /Users/cvetkom/Documents/chimera_sessions/20240502_CMGC4MCT_Fpl20MN_krios_merged_misc.cxs


===== Log before crash end =====

Log:
Startup Messages  
---  
warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
bundle with that from NMRSTAR bundle  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  




OpenGL version: 4.1 ATI-5.5.17
OpenGL renderer: AMD Radeon Pro 5500M OpenGL Engine
OpenGL vendor: ATI Technologies Inc.

Python: 3.11.2
Locale: UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Pro
      Model Identifier: MacBookPro16,1
      Processor Name: 8-Core Intel Core i9
      Processor Speed: 2.3 GHz
      Number of Processors: 1
      Total Number of Cores: 8
      L2 Cache (per Core): 256 KB
      L3 Cache: 16 MB
      Hyper-Threading Technology: Enabled
      Memory: 16 GB
      System Firmware Version: 2022.100.22.0.0 (iBridge: 21.16.4222.0.0,0)
      OS Loader Version: 580~1678

Software:

    System Software Overview:

      System Version: macOS 14.4.1 (23E224)
      Kernel Version: Darwin 23.4.0
      Time since boot: 11 days, 2 hours, 56 minutes

Graphics/Displays:

    Intel UHD Graphics 630:

      Chipset Model: Intel UHD Graphics 630
      Type: GPU
      Bus: Built-In
      VRAM (Dynamic, Max): 1536 MB
      Vendor: Intel
      Device ID: 0x3e9b
      Revision ID: 0x0002
      Automatic Graphics Switching: Supported
      gMux Version: 5.0.0
      Metal Support: Metal 3

    AMD Radeon Pro 5500M:

      Chipset Model: AMD Radeon Pro 5500M
      Type: GPU
      Bus: PCIe
      PCIe Lane Width: x16
      VRAM (Total): 8 GB
      Vendor: AMD (0x1002)
      Device ID: 0x7340
      Revision ID: 0x0040
      ROM Revision: 113-D3220E-190
      VBIOS Version: 113-D32206U1-019
      Option ROM Version: 113-D32206U1-019
      EFI Driver Version: 01.A1.190
      Automatic Graphics Switching: Supported
      gMux Version: 5.0.0
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-In Retina LCD
          Resolution: 3072 x 1920 Retina
          Framebuffer Depth: 24-Bit Color (ARGB8888)
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal
        DELL U2415:
          Resolution: 1920 x 1200 (WUXGA - Widescreen Ultra eXtended Graphics Array)
          UI Looks like: 1920 x 1200 @ 60.00Hz
          Framebuffer Depth: 30-Bit Color (ARGB2101010)
          Display Serial Number: 7MT016923MAL
          Mirror: Off
          Online: Yes
          Rotation: Supported
          Adapter Type: DVI or HDMI


Installed Packages:
    alabaster: 0.7.16
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.4.1
    Babel: 2.14.0
    backcall: 0.2.0
    beautifulsoup4: 4.11.2
    blockdiag: 3.0.0
    blosc2: 2.0.0
    build: 0.10.0
    certifi: 2022.12.7
    cftime: 1.6.3
    charset-normalizer: 3.3.2
    ChimeraX-AddCharge: 1.5.13
    ChimeraX-AddH: 2.2.5
    ChimeraX-AlignmentAlgorithms: 2.0.1
    ChimeraX-AlignmentHdrs: 3.4.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.12.2
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.1.1
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.49.1
    ChimeraX-AtomicLibrary: 12.1.5
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.3.2
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 2.1.2
    ChimeraX-BondRot: 2.0.4
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.10.5
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.3.2
    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.3.2
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.5
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.7.1
    ChimeraX-CoreFormats: 1.2
    ChimeraX-coulombic: 1.4.2
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.3
    ChimeraX-Dicom: 1.2
    ChimeraX-DistMonitor: 1.4
    ChimeraX-DockPrep: 1.1.3
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ESMFold: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.3
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.1.1
    ChimeraX-Hbonds: 2.4
    ChimeraX-Help: 1.2.2
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-Label: 1.1.8
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.1.6
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    ChimeraX-Map: 1.1.4
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0.1
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.2
    ChimeraX-MatchMaker: 2.1.2
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.6.1
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.12.1
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.14
    ChimeraX-ModelPanel: 1.4
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0.3
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.1
    ChimeraX-NRRD: 1.1
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.13.1
    ChimeraX-PDB: 2.7.3
    ChimeraX-PDBBio: 1.0.1
    ChimeraX-PDBLibrary: 1.0.4
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1
    ChimeraX-PubChem: 2.1
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.1
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.2
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 4.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.2
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.11
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.2
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.12.4
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.1.2
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.2.2
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.4
    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.33.3
    ChimeraX-uniprot: 2.3
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.3.2
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-vrml: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.3
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.1
    contourpy: 1.2.0
    cxservices: 1.2.2
    cycler: 0.12.1
    Cython: 0.29.33
    debugpy: 1.8.0
    decorator: 5.1.1
    docutils: 0.19
    executing: 2.0.1
    filelock: 3.9.0
    fonttools: 4.47.2
    funcparserlib: 2.0.0a0
    glfw: 2.6.4
    grako: 3.16.5
    h5py: 3.10.0
    html2text: 2020.1.16
    idna: 3.6
    ihm: 0.38
    imagecodecs: 2023.9.18
    imagesize: 1.4.1
    ipykernel: 6.23.2
    ipython: 8.14.0
    ipython-genutils: 0.2.0
    ipywidgets: 8.1.1
    jedi: 0.18.2
    Jinja2: 3.1.2
    jupyter-client: 8.2.0
    jupyter-core: 5.7.1
    jupyterlab-widgets: 3.0.9
    kiwisolver: 1.4.5
    line-profiler: 4.0.2
    lxml: 4.9.2
    lz4: 4.3.2
    MarkupSafe: 2.1.4
    matplotlib: 3.7.2
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.6.0
    netCDF4: 1.6.2
    networkx: 3.1
    nibabel: 5.0.1
    nptyping: 2.5.0
    numexpr: 2.8.8
    numpy: 1.25.1
    openvr: 1.23.701
    packaging: 21.3
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.9.0
    pickleshare: 0.7.5
    pillow: 10.2.0
    pip: 23.0
    pkginfo: 1.9.6
    platformdirs: 4.1.0
    prompt-toolkit: 3.0.43
    psutil: 5.9.5
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    py-cpuinfo: 9.0.0
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.16.1
    pynrrd: 1.0.0
    PyOpenGL: 3.1.7
    PyOpenGL-accelerate: 3.1.7
    pyopenxr: 1.0.2801
    pyparsing: 3.0.9
    pyproject-hooks: 1.0.0
    PyQt6-commercial: 6.3.1
    PyQt6-Qt6: 6.3.2
    PyQt6-sip: 13.4.0
    PyQt6-WebEngine-commercial: 6.3.1
    PyQt6-WebEngine-Qt6: 6.3.2
    python-dateutil: 2.8.2
    pytz: 2023.3.post1
    pyzmq: 25.1.2
    qtconsole: 5.4.3
    QtPy: 2.4.1
    RandomWords: 0.4.0
    requests: 2.31.0
    scipy: 1.11.1
    setuptools: 67.4.0
    setuptools-scm: 7.0.5
    sfftk-rw: 0.7.3
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.5
    sphinx: 6.1.3
    sphinx-autodoc-typehints: 1.22
    sphinxcontrib-applehelp: 1.0.8
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.6
    sphinxcontrib-htmlhelp: 2.0.5
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.7
    sphinxcontrib-serializinghtml: 1.1.10
    stack-data: 0.6.3
    superqt: 0.5.0
    tables: 3.8.0
    tcia-utils: 1.5.1
    tifffile: 2023.7.18
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.4
    traitlets: 5.9.0
    typing-extensions: 4.9.0
    tzdata: 2023.4
    urllib3: 2.1.0
    wcwidth: 0.2.13
    webcolors: 1.12
    wheel: 0.38.4
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.9

}}}
"	defect	closed	normal		Core		duplicate		Tom Goddard				all	ChimeraX
