﻿id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
19870	Crash on Mac waking from sleep	helen.duyvesteyn@…	Tom Goddard	"{{{
The following bug report has been submitted:
Platform:        macOS-15.6-arm64-arm-64bit
ChimeraX Version: 1.10 (2025-06-26 08:57:52 UTC)
Description
Last time you used ChimeraX it crashed.
This is a known crash that we are unable to fix. Here is information that may help you avoid this crash. The Qt window toolkit crashed due to a display configuration change, typically when waking from sleep or when an external display is disconnected or connected. This has only been seen on Mac computers. We hope a newer version of Qt will fix it. We update ChimeraX daily builds whenever a new Qt is released. You can check here https://www.cgl.ucsf.edu/chimerax/docs/troubleshoot.html#macdisplay to see if it has been fixed in a newer ChimeraX.
Fatal Python error: Segmentation fault

Thread 0x00000003486af000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 579 in _handle_results
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x00000003476a3000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 531 in _handle_tasks
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x0000000346697000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/selectors.py"", line 415 in select
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/connection.py"", line 930 in wait
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 502 in _wait_for_updates
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 522 in _handle_workers
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000034568b000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000034467f000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x0000000343673000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x0000000342667000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000034165b000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000034064f000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033f643000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033e637000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033d62b000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033c61f000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033b613000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Thread 0x000000033a607000 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/multiprocessing/pool.py"", line 114 in worker
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 975 in run
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 1038 in _bootstrap_inner
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py"", line 995 in _bootstrap

Current thread 0x00000002004060c0 (most recent call first):
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py"", line 368 in event_loop
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 1057 in init
  File ""/Applications/ChimeraX-1.10.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py"", line 1220 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.QtNetwork, PyQt6.QtPrintSupport, PyQt6.QtWebChannel, PyQt6.QtWebEngineCore, PyQt6.QtWebEngineWidgets, psutil._psutil_osx, psutil._psutil_posix, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.map._map, chimerax.pdb_lib._load_libs, chimerax.surface._surface, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, PIL._imaging, PIL._imagingmath, chimerax.pdb._pdbio, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize (total: 55)


{""app_name"":""ChimeraX"",""timestamp"":""2026-02-19 17:13:13.00 +0000"",""app_version"":""1.10.0"",""slice_uuid"":""9cf8124a-d876-34ad-b7ee-c011183ebc15"",""build_version"":""1.10.0.0"",""platform"":1,""bundleID"":""edu.ucsf.cgl.ChimeraX"",""share_with_app_devs"":0,""is_first_party"":0,""bug_type"":""309"",""os_version"":""macOS 15.6 (24G84)"",""roots_installed"":0,""name"":""ChimeraX"",""incident_id"":""0EA31C16-DA0B-4EE0-A7E2-D85C89A7BA44""}
{
  ""uptime"" : 23000,
  ""procRole"" : ""Background"",
  ""version"" : 2,
  ""userID"" : 501,
  ""deployVersion"" : 210,
  ""modelCode"" : ""Mac14,9"",
  ""coalitionID"" : 2887,
  ""osVersion"" : {
    ""train"" : ""macOS 15.6"",
    ""build"" : ""24G84"",
    ""releaseType"" : ""User""
  },
  ""captureTime"" : ""2026-02-19 17:05:23.6964 +0000"",
  ""codeSigningMonitor"" : 1,
  ""incident"" : ""0EA31C16-DA0B-4EE0-A7E2-D85C89A7BA44"",
  ""pid"" : 2514,
  ""translated"" : false,
  ""cpuType"" : ""ARM-64"",
  ""roots_installed"" : 0,
  ""bug_type"" : ""309"",
  ""procLaunch"" : ""2026-02-19 11:04:29.0292 +0000"",
  ""procStartAbsTime"" : 135691827840,
  ""procExitAbsTime"" : 564616304259,
  ""procName"" : ""ChimeraX"",
  ""procPath"" : ""\/Applications\/ChimeraX-1.10.app\/Contents\/MacOS\/ChimeraX"",
  ""bundleInfo"" : {""CFBundleShortVersionString"":""1.10.0"",""CFBundleVersion"":""1.10.0.0"",""CFBundleIdentifier"":""edu.ucsf.cgl.ChimeraX""},
  ""storeInfo"" : {""deviceIdentifierForVendor"":""44A2F365-9E12-538B-8DC9-FD5ED37321BC"",""thirdParty"":true},
  ""parentProc"" : ""launchd"",
  ""parentPid"" : 1,
  ""coalitionName"" : ""edu.ucsf.cgl.ChimeraX"",
  ""crashReporterKey"" : ""B97F65CB-AB70-2664-1BC6-992D64AA7B45"",
  ""lowPowerMode"" : 1,
  ""appleIntelligenceStatus"" : {""reasons"":[""siriAssetIsNotReady"",""notOptedIn"",""assetIsNotReady""],""state"":""unavailable""},
  ""codeSigningID"" : ""edu.ucsf.cgl.ChimeraX"",
  ""codeSigningTeamID"" : ""LWV8X224YF"",
  ""codeSigningFlags"" : 570491649,
  ""codeSigningValidationCategory"" : 6,
  ""codeSigningTrustLevel"" : 4294967295,
  ""codeSigningAuxiliaryInfo"" : 0,
  ""instructionByteStream"" : {""beforePC"":""fyMD1f17v6n9AwCRm+D\/l78DAJH9e8Go\/w9f1sADX9YQKYDSARAA1A=="",""atPC"":""AwEAVH8jA9X9e7+p\/QMAkZDg\/5e\/AwCR\/XvBqP8PX9bAA1\/WcAqA0g==""},
  ""bootSessionUUID"" : ""662559AD-112B-4C5D-95D3-6A5066F19C47"",
  ""wakeTime"" : 4328,
  ""sleepWakeUUID"" : ""0F015813-E933-4684-9CD8-671F49A42D23"",
  ""sip"" : ""enabled"",
  ""vmRegionInfo"" : ""0x20078836c5f0 is not in any region.  Bytes after previous region: 34735685813745  Bytes before following region: 70336394115600\n      REGION TYPE                    START - END         [ VSIZE] PRT\/MAX SHRMOD  REGION DETAIL\n      commpage (reserved)        1000000000-7000000000   [384.0G] ---\/--- SM=NUL  reserved VM address space (unallocated)\n--->  GAP OF 0x5f9000000000 BYTES\n      MALLOC_NANO              600000000000-600020000000 [512.0M] rw-\/rwx SM=PRV  "",
  ""exception"" : {""codes"":""0x0000000000000001, 0x0000a0078836c5f0"",""rawCodes"":[1,175954210506224],""type"":""EXC_BAD_ACCESS"",""signal"":""SIGSEGV"",""subtype"":""KERN_INVALID_ADDRESS at 0x0000a0078836c5f0 -> 0x000020078836c5f0 (possible pointer authentication failure)""},
  ""termination"" : {""flags"":0,""code"":11,""namespace"":""SIGNAL"",""indicator"":""Segmentation fault: 11"",""byProc"":""ChimeraX"",""byPid"":2514},
  ""vmregioninfo"" : ""0x20078836c5f0 is not in any region.  Bytes after previous region: 34735685813745  Bytes before following region: 70336394115600\n      REGION TYPE                    START - END         [ VSIZE] PRT\/MAX SHRMOD  REGION DETAIL\n      commpage (reserved)        1000000000-7000000000   [384.0G] ---\/--- SM=NUL  reserved VM address space (unallocated)\n--->  GAP OF 0x5f9000000000 BYTES\n      MALLOC_NANO              600000000000-600020000000 [512.0M] rw-\/rwx SM=PRV  "",
  ""extMods"" : {""caller"":{""thread_create"":0,""thread_set_state"":0,""task_for_pid"":0},""system"":{""thread_create"":0,""thread_set_state"":0,""task_for_pid"":0},""targeted"":{""thread_create"":0,""thread_set_state"":0,""task_for_pid"":0},""warnings"":0},
  ""faultingThread"" : 0,
  ""threads"" : [{""threadState"":{""x"":[{""value"":0},{""value"":0},{""value"":1},{""value"":5100567192},{""value"":99},{""value"":104},{""value"":5904761040},{""value"":1027},{""value"":8742178245366393788},{""value"":8742178236780661628},{""value"":14757395258967641293},{""value"":4294967286},{""value"":5100567122},{""value"":0},{""value"":53},{""value"":4294967280},{""value"":328},{""value"":8611288408},{""value"":0},{""value"":11},{""value"":259},{""value"":8594153888,""symbolLocation"":224,""symbol"":""_main_thread""},{""value"":0},{""value"":1},{""value"":4333454896,""symbolLocation"":0,""symbol"":""faulthandler_handlers""},{""value"":8555319296,""symbolLocation"":0,""symbol"":""OBJC_IVAR_$_NSTouchBarInputMethodCandidateList._list""},{""value"":8555319296,""symbolLocation"":0,""symbol"":""OBJC_IVAR_$_NSTouchBarInputMethodCandidateList._list""},{""value"":5},{""value"":1}],""flavor"":""ARM_THREAD_STATE64"",""lr"":{""value"":6749108364},""cpsr"":{""value"":1073745920},""fp"":{""value"":5100567264},""sp"":{""value"":5100567232},""esr"":{""value"":1442840704,""description"":"" 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===== Log before crash start =====
UCSF ChimeraX version: 1.10 (2025-06-26)  
© 2016-2025 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /Users/hmed/Downloads/cryosparc_P98_J17_006_volume_map_sharp.mrc

Opened cryosparc_P98_J17_006_volume_map_sharp.mrc as #1, grid size
480,480,480, pixel 0.831, shown at level 0.147, step 2, values float32  

> volume #1 level 0.447

> volume #1 step 1

> volume #1 level 0.4855

> lighting soft

> set bgColor white

> open /Users/hmed/Downloads/9EWQ.pdb /Users/hmed/Downloads/8E6K.pdb
> /Users/hmed/Downloads/8E6K.cif ""/Users/hmed/Downloads/8E6J 1.pdb""
> /Users/hmed/Downloads/9KOD.pdb

9EWQ.pdb title:  
Influenza virus neuraminidase N1 NC13 ectodomain with A tetrabrachio- domain
stalk [more info...]  
  
Chain information for 9EWQ.pdb #2  
---  
Chain | Description  
A B C D | neuraminidase  
  
8E6K.pdb title:  
2H08 fab In complex with influenza virus neuraminidase from A/brevig
mission/1/1918 (H1N1) [more info...]  
  
Chain information for 8E6K.pdb #3  
---  
Chain | Description | UniProt  
A B C D | neuraminidase | NRAM_I18A0 82-470  
E F G H | 2H08 fragment antigen binding heavy chain |   
I J K L | 2H08 fragment antigen binding light chain |   
  
Non-standard residues in 8E6K.pdb #3  
---  
NAG — 2-acetamido-2-deoxy-β-D-glucopyranose (N-acetyl-β-D-glucosamine;
2-acetamido-2-deoxy-β-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-acetyl-D-glucosamine)  
  
8E6K.cif title:  
2H08 Fab in complex with influenza virus neuraminidase from A/Brevig
Mission/1/1918 (H1N1) [more info...]  
  
Chain information for 8E6K.cif #4  
---  
Chain | Description | UniProt  
A B C D | Neuraminidase | NRAM_I18A0 82-470  
E F G H | 2H08 fragment antigen binding heavy chain |   
I J K L | 2H08 fragment antigen binding light chain |   
  
Non-standard residues in 8E6K.cif #4  
---  
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)  
  
8E6J 1.pdb title:  
3H03 fab In complex with influenza virus neuraminidase from A/brevig
mission/1/1918 (H1N1) [more info...]  
  
Chain information for 8E6J 1.pdb #5  
---  
Chain | Description | UniProt  
A B C D | neuraminidase | NRAM_I18A0 82-470  
E F G H | 3H03 fragment antigen binding heavy chain |   
I J K L | 3H03 fragment antigen binding light chain |   
  
9KOD.pdb title:  
Neuraminidase of A/dairy cow/minnesota/24_016288-003/2024 (DCMN24 N1) In
complex with cav-F6 fab [more info...]  
  
Chain information for 9KOD.pdb #6  
---  
Chain | Description  
A B C D | neuraminidase  
E G I K | cav-F6 heavy chain  
F H J L | cav-F6 κ chain  
  
Non-standard residues in 9KOD.pdb #6  
---  
CA — calcium ion  
NAG — 2-acetamido-2-deoxy-β-D-glucopyranose (N-acetyl-β-D-glucosamine;
2-acetamido-2-deoxy-β-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-acetyl-D-glucosamine)  
  

> show cartoons

> hide atoms

> hide #2 models

> hide #3 models

> hide #4 models

> hide #5 models

> show #5 models

> hide #!6 models

> hide #5 models

> show #4 models

> show #3 models

> hide #4 models

> show #2 models

> hide #3 models

> select add #2

11904 atoms, 12254 bonds, 1540 residues, 1 model selected  

> ui mousemode right ""rotate selected models""

> view matrix models
> #2,-0.13135,0.10157,-0.98612,380.79,0.35371,0.93407,0.049093,-66.226,0.92609,-0.34235,-0.15861,88.915

> ui mousemode right ""translate selected models""

> view matrix models
> #2,-0.13135,0.10157,-0.98612,387.26,0.35371,0.93407,0.049093,-67.115,0.92609,-0.34235,-0.15861,112.3

> view matrix models
> #2,-0.13135,0.10157,-0.98612,380.66,0.35371,0.93407,0.049093,-68.91,0.92609,-0.34235,-0.15861,110.6

> view matrix models
> #2,-0.13135,0.10157,-0.98612,380.43,0.35371,0.93407,0.049093,-66.765,0.92609,-0.34235,-0.15861,110.83

> ui tool show ""Fit in Map""

> fitmap #2 inMap #1

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc
(#1) using 11904 atoms  
average map value = 0.2725, steps = 72  
shifted from previous position = 2.66  
rotated from previous position = 4.86 degrees  
atoms outside contour = 8459, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc (#1) coordinates:  
Matrix rotation and translation  
-0.09281877 0.17057375 -0.98096344 357.40958835  
0.33443205 0.93332040 0.13064543 -75.28601928  
0.93783787 -0.31593927 -0.14367498 98.90011257  
Axis -0.22590289 -0.97061714 0.08288699  
Axis point 143.75589202 0.00000000 204.32008668  
Rotation angle (degrees) 98.71888807  
Shift along axis 0.53157525  
  

> view matrix models
> #2,-0.092819,0.17057,-0.98096,350.34,0.33443,0.93332,0.13065,-77.276,0.93784,-0.31594,-0.14367,98.688

> fitmap #2 inMap #1

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc
(#1) using 11904 atoms  
average map value = 0.2736, steps = 76  
shifted from previous position = 5.11  
rotated from previous position = 4.72 degrees  
atoms outside contour = 8442, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc (#1) coordinates:  
Matrix rotation and translation  
-0.10049857 0.09039277 -0.99082248 374.45820913  
0.34018612 0.93896558 0.05115698 -63.64741394  
0.93497243 -0.33192285 -0.12511506 99.27621483  
Axis -0.19353804 -0.97294229 0.12619958  
Axis point 149.50844549 0.00000000 212.25594943  
Rotation angle (degrees) 98.24023898  
Shift along axis 1.98197032  
  

> volume flip #1

Opened cryosparc_P98_J17_006_volume_map_sharp.mrc z flip as #7, grid size
480,480,480, pixel 0.831, shown at step 1, values float32  

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 0.2632, steps = 100  
shifted from previous position = 3.59  
rotated from previous position = 5.27 degrees  
atoms outside contour = 8542, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.05253495 0.06180782 -0.99670451 374.33565591  
0.27018465 0.96173761 0.04539838 -52.84835005  
0.96137419 -0.26690926 -0.06722436 68.34519241  
Axis -0.15664353 -0.98210966 0.10451516  
Axis point 159.25609690 0.00000000 207.46075764  
Rotation angle (degrees) 94.53171170  
Shift along axis 0.40872691  
  

> view matrix models
> #2,-0.052535,0.061808,-0.9967,375.34,0.27018,0.96174,0.045398,-58.207,0.96137,-0.26691,-0.067224,68.988

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 0.2515, steps = 68  
shifted from previous position = 1.12  
rotated from previous position = 1.17 degrees  
atoms outside contour = 8618, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.03762832 0.06642827 -0.99708144 371.47542737  
0.28323263 0.95757968 0.05310779 -60.88035135  
0.95831278 -0.28040764 -0.05484676 69.08170078  
Axis -0.16713832 -0.97992859 0.10864960  
Axis point 158.24674010 0.00000000 208.73177237  
Rotation angle (degrees) 93.86740467  
Shift along axis 5.07631637  
  

> view matrix models
> #2,-0.037628,0.066428,-0.99708,371.83,0.28323,0.95758,0.053108,-58.797,0.95831,-0.28041,-0.054847,73.062

> ui mousemode right ""rotate selected models""

> view matrix models
> #2,0.11024,0.10966,0.98784,-18.559,-0.4764,-0.86645,0.14935,440.56,0.87229,-0.48707,-0.043275,129.51

> view matrix models
> #2,-0.053039,-0.046928,0.99749,43.662,-0.25359,-0.96552,-0.058908,452.78,0.96586,-0.25607,0.03931,49.983

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 1.152, steps = 72  
shifted from previous position = 4.51  
rotated from previous position = 3.24 degrees  
atoms outside contour = 2044, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.00987940 -0.01052014 0.99989586 22.93547162  
-0.25270803 -0.96745955 -0.01267574 445.77948485  
0.96749215 -0.25280694 0.00689940 54.88121692  
Axis -0.70092864 0.09458450 -0.70693197  
Axis point 11.53851492 225.70514329 0.00000000  
Rotation angle (degrees) 170.13687580  
Shift along axis -12.70958685  
  

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 1.152, steps = 40  
shifted from previous position = 0.00978  
rotated from previous position = 0.0132 degrees  
atoms outside contour = 2048, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.00987601 -0.01049475 0.99989616 22.93170695  
-0.25248749 -0.96751748 -0.01264874 445.74002113  
0.96754976 -0.25258619 0.00690542 54.83382387  
Axis -0.70093429 0.09449421 -0.70693844  
Axis point 11.53491689 225.68001116 0.00000000  
Rotation angle (degrees) 170.14499369  
Shift along axis -12.71790661  
  

> view matrix models
> #2,-0.15828,-0.027182,0.98702,58.214,-0.42118,-0.90226,-0.092391,480.56,0.89306,-0.43034,0.13137,83.169

> fitmap #2 inMap #1

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc
(#1) using 11904 atoms  
average map value = 0.3066, steps = 132  
shifted from previous position = 0.463  
rotated from previous position = 9.05 degrees  
atoms outside contour = 8152, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc (#1) coordinates:  
Matrix rotation and translation  
-0.00301887 -0.02731687 0.99962227 24.50012686  
-0.40343203 -0.91463407 -0.02621274 467.71513425  
0.91500464 -0.40335877 -0.00825934 98.29065867  
Axis -0.69930419 0.15689801 -0.69739276  
Axis point 0.00000000 245.41797874 -9.20044743  
Rotation angle (degrees) 164.35607923  
Shift along axis -12.29665966  
  

> hide #!1 models

> show #!7 models

> fitmap #2 inMap #1

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc
(#1) using 11904 atoms  
average map value = 0.3066, steps = 40  
shifted from previous position = 0.00635  
rotated from previous position = 0.00657 degrees  
atoms outside contour = 8148, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc (#1) coordinates:  
Matrix rotation and translation  
-0.00296760 -0.02721697 0.99962515 24.46847205  
-0.40345309 -0.91462799 -0.02610047 467.70309669  
0.91499552 -0.40337931 -0.00826652 98.29402159  
Axis -0.69931820 0.15686816 -0.69738543  
Axis point 0.00000000 245.41132949 -9.19630927  
Rotation angle (degrees) 164.35075058  
Shift along axis -12.29234096  
  

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 0.3252, steps = 60  
shifted from previous position = 0.739  
rotated from previous position = 2.25 degrees  
atoms outside contour = 7878, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.00174977 0.00576348 0.99998186 18.30333898  
-0.38393894 -0.92334678 0.00464997 460.04815818  
0.92335683 -0.38392384 0.00382847 90.49230864  
Axis -0.69933430 0.13790562 -0.70136551  
Axis point 10.68718086 237.97767186 0.00000000  
Rotation angle (degrees) 163.87004477  
Shift along axis -12.82510838  
  

> view matrix models
> #2,0.012789,-0.022289,0.99967,21.06,-0.38553,-0.92256,-0.015637,463.81,0.92261,-0.38521,-0.020392,95.196

> view matrix models
> #2,0.062532,0.022652,0.99779,2.4693,-0.36642,-0.92941,0.044063,450.76,0.92835,-0.36836,-0.049817,95.903

> view matrix models
> #2,0.05903,0.040139,0.99745,-0.26653,-0.23537,-0.97046,0.052983,431.2,0.97011,-0.23789,-0.047839,61.125

> fitmap #2 inMap #7

Fit molecule 9EWQ.pdb (#2) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 11904 atoms  
average map value = 1.152, steps = 72  
shifted from previous position = 0.258  
rotated from previous position = 4.99 degrees  
atoms outside contour = 2045, contour level = 0.48546  
  
Position of 9EWQ.pdb (#2) relative to
cryosparc_P98_J17_006_volume_map_sharp.mrc z flip (#7) coordinates:  
Matrix rotation and translation  
-0.00989525 -0.01050721 0.99989584 22.94019453  
-0.25268689 -0.96746519 -0.01266708 445.77120526  
0.96749751 -0.25278591 0.00691828 54.88872601  
Axis -0.70092318 0.09457293 -0.70693893  
Axis point 11.53572521 225.70140825 0.00000000  
Rotation angle (degrees) 170.13731151  
Shift along axis -12.72440343  
  

> select subtract #2

Nothing selected  

> transparency #7.1 50

> graphics silhouettes true

> show #2 atoms

> color #2 #daeeefff

> ui tool show ""Side View""

> ui tool show ""Show Sequence Viewer""

> sequence chain #2/A

Alignment identifier is 2/A  

> select #2:119

32 atoms, 28 bonds, 4 residues, 1 model selected  

> select #2:178

36 atoms, 32 bonds, 4 residues, 1 model selected  

> select #2:98

32 atoms, 28 bonds, 4 residues, 1 model selected  

> select #2/A:89

14 atoms, 15 bonds, 1 residue, 1 model selected  

> select #2/A:89-92

31 atoms, 32 bonds, 4 residues, 1 model selected  

> select #2/A:90

6 atoms, 5 bonds, 1 residue, 1 model selected  

> select #2/A:89-90

20 atoms, 21 bonds, 2 residues, 1 model selected  

> color sel lime

> select #2/A:29

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:29-30

16 atoms, 16 bonds, 2 residues, 1 model selected  

> select #2/A:38

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:38-39

15 atoms, 14 bonds, 2 residues, 1 model selected  

> select #2/A:40

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #2/A:40

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #2/A:29

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:29-31

27 atoms, 28 bonds, 3 residues, 1 model selected  

> select #2/A:62-63

17 atoms, 16 bonds, 2 residues, 1 model selected  

> select #2/A:62-63

17 atoms, 16 bonds, 2 residues, 1 model selected  

> select #2/A:89

14 atoms, 15 bonds, 1 residue, 1 model selected  

> select #2/A:89-90

20 atoms, 21 bonds, 2 residues, 1 model selected  

> select #2/A:109

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:109-110

14 atoms, 13 bonds, 2 residues, 1 model selected  

> select #2/A:133

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:133

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:138

9 atoms, 8 bonds, 1 residue, 1 model selected  

> open 8gav fromDatabase pdb format mmcif

Summary of feedback from opening 8gav fetched from pdb  
---  
note | Fetching compressed mmCIF 8gav from http://files.rcsb.org/download/8gav.cif  
  
8gav title:  
Structure of human NDS.3 Fab in complex with influenza virus neuraminidase
from A/Darwin/09/2021 (H3N2) [more info...]  
  
Chain information for 8gav #8  
---  
Chain | Description | UniProt  
A | Neuraminidase | A0A8F5JTQ6_9INFA 83-469  
H | Fab NDS.3, heavy chain |   
L | Fab NDS.3, light chain |   
  
Non-standard residues in 8gav #8  
---  
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)  
  
8gav mmCIF Assemblies  
---  
1| complete point assembly  
2| point asymmetric unit  
3| point asymmetric unit, std point frame  
  

> mmaker #8 to #2

Parameters  
---  
Chain pairing | bb  
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 9EWQ.pdb, chain A (#2) with 8gav, chain A (#8), sequence alignment
score = 1086  
RMSD between 328 pruned atom pairs is 0.889 angstroms; (across all 380 pairs:
1.562)  
  

> ui tool show ""Fit in Map""

> fitmap #8 inMap #7

Fit molecule 8gav (#8) to map cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) using 4772 atoms  
average map value = 0.516, steps = 120  
shifted from previous position = 0.427  
rotated from previous position = 0.875 degrees  
atoms outside contour = 2875, contour level = 0.48546  
  
Position of 8gav (#8) relative to cryosparc_P98_J17_006_volume_map_sharp.mrc z
flip (#7) coordinates:  
Matrix rotation and translation  
-0.00251203 0.03493684 0.99938637 45.29122065  
-0.70320371 -0.71061390 0.02307430 428.34348486  
0.71098399 -0.70271423 0.02635280 193.39791159  
Axis -0.67539430 0.26837751 -0.68688867  
Axis point 21.20795431 249.29029248 0.00000000  
Rotation angle (degrees) 147.49947978  
Shift along axis -48.47450813  
  

> close #1

> select add #2

11904 atoms, 12254 bonds, 1540 residues, 1 model selected  

> select subtract #2

Nothing selected  

> hide #8 models

> color A red

Expected a color or one of 'byatom', 'bychain', 'byelement', 'byhetero',
'byidentity', 'bymodel', 'bynucleotide', 'bypolymer', 'fromatoms',
'fromcartoons', 'fromribbons', or 'random' or a keyword  

> hide #!7 models

> color /A red

> color /B blue

> color /C cyan

> color /D green

> color /A paleblue

Expected a color or one of 'byatom', 'bychain', 'byelement', 'byhetero',
'byidentity', 'bymodel', 'bynucleotide', 'bypolymer', 'fromatoms',
'fromcartoons', 'fromribbons', or 'random' or a keyword  

> color /A lightblue

> color /B lightblue

> color /A blue

> color bychain pallette Paired-12

Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels',
'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword  

> color chains pallette Paired-12

Expected a color or one of 'byatom', 'bychain', 'byelement', 'byhetero',
'byidentity', 'bymodel', 'bynucleotide', 'bypolymer', 'fromatoms',
'fromcartoons', 'fromribbons', or 'random' or a keyword  

> color random pallette Paired-12

Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels',
'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword  

> color random bonds pallette Paired-12

Expected ',' or a keyword  

> color random bonds, pallette Paired-12

Missing or invalid ""what"" argument: Should be one of 'All', 'atoms', 'bonds',
'cartoons', 'labels', 'models', 'pseudobonds', 'ribbons', 'rings', or
'surfaces'  

> runscript |~/apps/viridis_colormaps.py

Missing or invalid ""scriptFile"" argument: File '|~/apps/viridis_colormaps.py'
does not exist  

> runscript ~/apps/viridis_colormaps.py

Missing or invalid ""scriptFile"" argument: File
'/Users/hmed/apps/viridis_colormaps.py' does not exist  

> pwd

Current working directory is: /Users/hmed/Desktop  

> pwd

Current working directory is: /Users/hmed/Desktop  

> runscript /Users/hmed/apps/viridis_colormaps.py

Missing or invalid ""scriptFile"" argument: File
'/Users/hmed/apps/viridis_colormaps.py' does not exist  

> runscript /Users/hmed/apps/viridis_colormaps/viridis_colormaps.py

Missing or invalid ""scriptFile"" argument: File
'/Users/hmed/apps/viridis_colormaps/viridis_colormaps.py' does not exist  

> runscript /Users/hmed/apps/chimerax_viridis/viridis_colormaps.py

New colormaps: `inferno`, `magma`, `plasma`, `viridis`, `cividis`, `turbo`  
Default colormap for `rainbow` set to 'turbo'  
To unpatch, run `runscript viridis_colormaps.py --reset_defaults`  

> color #2 bychain

> color #2 bychain pallette inferno

Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels',
'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword  

> color #2 bychain palette inferno

Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels',
'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword  

> color sequential #2 bychain palette inferno

Expected one of 'chains', 'polymers', 'residues', or 'structures' or a keyword  

> lighting soft msMapSize 64

> cartoon style protein modeHelix default arrows false xsection oval width 1
> thickness 1

> cartoon style strand modeHelix default arrows true xsection rectangle width
> 2 thickness 1

> cartoon style helix modeHelix default arrows false xsection oval width 1.6
> thickness 1.2

> graphics silhouettes width 3

> graphics silhouettes true

> lighting_lumi

Unknown command: lighting_lumi  

> rainbow Template target c palette ^PuBu-5

Expected one of 'chains', 'polymers', 'residues', or 'structures' or a keyword  

> rainbow chains target c palette ^pubu-5

> hide #2 atoms

> rainbow chains target c palette inferno

Fetching compressed palette rubo from
https://www.colourlovers.com/api/palettes?keywords=rubo&format=json&numResults=100  
Could not find palette rubo at COLOURlovers.com using keyword search  

> rainbow chains target c palette turbo

> show #!7 models

> select #2/A:210

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:210

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:217

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:217

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:219-220

16 atoms, 15 bonds, 2 residues, 1 model selected  

> select #2/A:219-221

25 atoms, 24 bonds, 3 residues, 1 model selected  

> select #2/A:205

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:205

8 atoms, 7 bonds, 1 residue, 1 model selected  

> select #2/A:343

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:343-344

17 atoms, 16 bonds, 2 residues, 1 model selected  

> select #2/A:342

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:342

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:372

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:371-372

14 atoms, 13 bonds, 2 residues, 1 model selected  

> select #2/A:342

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:342

9 atoms, 8 bonds, 1 residue, 1 model selected  

> select #2/A:312

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #2/A:312

12 atoms, 12 bonds, 1 residue, 1 model selected  

> select #2/A:278

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #2/A:278

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select :29,62,89,90,1009,133,138,188,205

2155 atoms, 1997 bonds, 270 residues, 6 models selected  

> show sel & #2 atoms

> color sel & #2 byhetero

> color (#2 & sel) hot pink

> color sel & #2 byhetero

> select :28,61,62,135,187,203,278,312

1771 atoms, 1635 bonds, 219 residues, 6 models selected  

> color (#2 & sel) lime

> style sel & #2 stick

Changed 336 atom styles  

> show sel & #2 atoms

> color sel & #2 byhetero

> select add #8

6464 atoms, 6458 bonds, 827 residues, 6 models selected  

> select add #2

18032 atoms, 18400 bonds, 2335 residues, 6 models selected  

> select add #3

36624 atoms, 37560 bonds, 4751 residues, 6 models selected  

> select subtract #3

17692 atoms, 18084 bonds, 2291 residues, 5 models selected  

> select subtract #2

5788 atoms, 5830 bonds, 751 residues, 4 models selected  

> select add #4

24380 atoms, 24990 bonds, 3167 residues, 4 models selected  

> select subtract #4

5448 atoms, 5514 bonds, 707 residues, 3 models selected  

> select add #5

24112 atoms, 24738 bonds, 3131 residues, 3 models selected  

> select subtract #5

5104 atoms, 5194 bonds, 663 residues, 2 models selected  

> select add #6

23920 atoms, 24590 bonds, 34 pseudobonds, 3103 residues, 3 models selected  

> select subtract #6

4772 atoms, 4894 bonds, 619 residues, 1 model selected  

> select subtract #8

Nothing selected  

> select add #8

4772 atoms, 4894 bonds, 619 residues, 1 model selected  

> show #3 models

> hide #3 models

> show #4 models

> hide #4 models

> mmaker #3-6 to #2

Parameters  
---  
Chain pairing | bb  
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 9EWQ.pdb, chain A (#2) with 8E6K.pdb, chain A (#3), sequence
alignment score = 1889  
RMSD between 382 pruned atom pairs is 0.556 angstroms; (across all 385 pairs:
0.722)  
  
Matchmaker 9EWQ.pdb, chain A (#2) with 8E6K.cif, chain A (#4), sequence
alignment score = 1889  
RMSD between 382 pruned atom pairs is 0.556 angstroms; (across all 385 pairs:
0.722)  
  
Matchmaker 9EWQ.pdb, chain A (#2) with 8E6J 1.pdb, chain A (#5), sequence
alignment score = 1896.2  
RMSD between 382 pruned atom pairs is 0.517 angstroms; (across all 385 pairs:
0.692)  
  
Matchmaker 9EWQ.pdb, chain A (#2) with 9KOD.pdb, chain A (#6), sequence
alignment score = 1924.4  
RMSD between 385 pruned atom pairs is 0.352 angstroms; (across all 385 pairs:
0.352)  
  

> show #!6 models

> hide #!7 models

> show #!7 models

> hide #!7 models

> hide #!6 models

> show #!6 models

> hide #!6 models

> show #!6 models

> hide #2 models

> show #2 models

> hide #2 models

> show #2 models

> hide #2 models

> show #5 models

> show #4 models

> hide #4 models

> show #4 models

> hide #4 models

> show #3 models

> hide #3 models

> show #3 models

> hide #3 models

> show #8 models

> hide #8 models

> show #4 models

> hide #5 models

> hide #4 models

> show #!7 models

> hide #!6 models

> hide #!7 models

> show #8 models

> hide #8 models

> show #8 models

> show #2 models

> select subtract #8

Nothing selected  

> save /Users/hmed/Documents/dongdong/fluN1experiments/allon2A11.cxs

> save /Users/hmed/Documents/dongdong/fluN1experiments/P98_J17z.mrc models #7


===== Log before crash end =====

Log:
UCSF ChimeraX version: 1.10 (2025-06-26)  
© 2016-2025 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  




OpenGL version: 4.1 Metal - 89.4
OpenGL renderer: Apple M2 Pro
OpenGL vendor: Apple

Python: 3.11.4
Locale: en_US.UTF-8
Qt version: PyQt6 6.8.1, Qt 6.8.2
Qt runtime version: 6.8.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Pro
      Model Identifier: Mac14,9
      Model Number: MPHF3B/A
      Chip: Apple M2 Pro
      Total Number of Cores: 12 (8 performance and 4 efficiency)
      Memory: 16 GB
      System Firmware Version: 11881.140.96
      OS Loader Version: 11881.140.96

Software:

    System Software Overview:

      System Version: macOS 15.6 (24G84)
      Kernel Version: Darwin 24.6.0
      Time since boot: 9 hours, 6 minutes

Graphics/Displays:

    Apple M2 Pro:

      Chipset Model: Apple M2 Pro
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 19
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-in Liquid Retina XDR Display
          Resolution: 3024 x 1964 Retina
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal


Installed Packages:
    alabaster: 1.0.0
    appdirs: 1.4.4
    appnope: 0.1.4
    asttokens: 3.0.0
    auditwheel: 6.4.0
    babel: 2.17.0
    beautifulsoup4: 4.13.3
    blockdiag: 3.0.0
    blosc2: 3.5.0
    build: 1.2.2.post1
    certifi: 2023.11.17
    cftime: 1.6.4.post1
    charset-normalizer: 3.4.2
    ChimeraX-AddCharge: 1.5.19
    ChimeraX-AddH: 2.2.7
    ChimeraX-AlignmentAlgorithms: 2.0.2
    ChimeraX-AlignmentHdrs: 3.6.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.20.2
    ChimeraX-AlphaFold: 1.0.1
    ChimeraX-AltlocExplorer: 1.1.2
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Aniso: 1.1.4
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.60.7
    ChimeraX-AtomicLibrary: 14.1.18
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.4
    ChimeraX-BasicActions: 1.1.3
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 3.0.0
    ChimeraX-Boltz: 1.0
    ChimeraX-BondRot: 2.0.4
    ChimeraX-BugReporter: 1.0.2
    ChimeraX-BuildStructure: 2.13.1
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.5.1
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.4
    ChimeraX-ChangeChains: 1.1
    ChimeraX-CheckWaters: 1.5
    ChimeraX-ChemGroup: 2.0.2
    ChimeraX-Clashes: 2.3
    ChimeraX-ColorActions: 1.0.5
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.8
    ChimeraX-CommandLine: 1.3
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.10
    ChimeraX-CoreFormats: 1.2
    ChimeraX-coulombic: 1.4.5
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.4
    ChimeraX-Dicom: 1.2.7
    ChimeraX-DistMonitor: 1.4.2
    ChimeraX-DockPrep: 1.1.4
    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: 1.4.1
    ChimeraX-Hbonds: 2.5.1
    ChimeraX-Help: 1.3
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.3
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-KVFinder: 1.6.2
    ChimeraX-Label: 1.1.14
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.2
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    ChimeraX-Map: 1.3
    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: 2.2.2
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.10.1
    ChimeraX-MedicalToolbar: 1.1
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.16
    ChimeraX-MMTF: 2.2
    ChimeraX-ModelArchive: 1.0
    ChimeraX-Modeller: 1.5.19
    ChimeraX-ModelPanel: 1.5.1
    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-MutationScores: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.2
    ChimeraX-NMRSTAR: 1.0.2
    ChimeraX-NRRD: 1.2
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.14.1
    ChimeraX-OrthoPick: 1.0.1
    ChimeraX-PDB: 2.7.10
    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: 1.1.3
    ChimeraX-ProfileGrids: 1.1.2
    ChimeraX-PubChem: 2.2
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.6.3
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.3.1
    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: 2.0.3
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-Segmentations: 3.5.7
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.17.1
    ChimeraX-Shape: 1.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.2.1
    ChimeraX-ShowSequences: 1.0.3
    ChimeraX-SideView: 1.0.1
    ChimeraX-SimilarStructures: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.19.1
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.2.1
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.5.2
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.2.3
    ChimeraX-ToolshedUtils: 1.2.4
    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.45.2
    ChimeraX-Umap: 1.0
    ChimeraX-uniprot: 2.3.1
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.4.4
    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: 1.1.5
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.2
    contourpy: 1.3.2
    coverage: 7.9.1
    cxservices: 1.2.3
    cycler: 0.12.1
    Cython: 3.0.12
    debugpy: 1.8.14
    decorator: 5.2.1
    docutils: 0.21.2
    executing: 2.2.0
    filelock: 3.18.0
    fonttools: 4.58.4
    funcparserlib: 2.0.0a0
    glfw: 2.9.0
    grako: 3.16.5
    h5py: 3.14.0
    html2text: 2024.2.26
    idna: 3.10
    ihm: 2.2
    imagecodecs: 2024.6.1
    imagesize: 1.4.1
    iniconfig: 2.1.0
    ipykernel: 6.29.5
    ipython: 8.26.0
    ipywidgets: 8.1.7
    jedi: 0.19.1
    Jinja2: 3.1.6
    jupyter_client: 8.6.3
    jupyter_core: 5.8.1
    jupyterlab_widgets: 3.0.15
    kiwisolver: 1.4.8
    line_profiler: 4.2.0
    lxml: 5.3.1
    lz4: 4.4.4
    MarkupSafe: 3.0.2
    matplotlib: 3.10.1
    matplotlib-inline: 0.1.7
    msgpack: 1.1.0
    ndindex: 1.10.0
    nest-asyncio: 1.6.0
    netCDF4: 1.6.5
    networkx: 3.3
    nibabel: 5.2.0
    nptyping: 2.5.0
    numexpr: 2.11.0
    numpy: 1.26.4
    OpenMM: 8.2.0
    openvr: 1.26.701
    packaging: 24.2
    ParmEd: 4.2.2
    parso: 0.8.4
    pep517: 0.13.1
    pexpect: 4.9.0
    pickleshare: 0.7.5
    pillow: 10.4.0
    pip: 25.0.1
    pkginfo: 1.11.1
    platformdirs: 4.3.8
    pluggy: 1.6.0
    prompt_toolkit: 3.0.51
    psutil: 7.0.0
    ptyprocess: 0.7.0
    pure_eval: 0.2.3
    py-cpuinfo: 9.0.0
    pycollada: 0.8
    pydicom: 2.4.4
    pyelftools: 0.32
    Pygments: 2.18.0
    pynmrstar: 3.3.5
    pynrrd: 1.0.0
    PyOpenGL: 3.1.9
    PyOpenGL-accelerate: 3.1.9
    pyopenxr: 1.1.4501
    pyparsing: 3.2.3
    pyproject_hooks: 1.2.0
    PyQt6-commercial: 6.8.1
    PyQt6-Qt6: 6.8.2
    PyQt6-WebEngine-commercial: 6.8.0
    PyQt6-WebEngine-Qt6: 6.8.2
    PyQt6_sip: 13.10.0
    pytest: 8.4.1
    pytest-cov: 6.2.1
    python-dateutil: 2.9.0.post0
    pytz: 2025.2
    pyzmq: 27.0.0
    qtconsole: 5.5.2
    QtPy: 2.4.3
    qtshim: 1.1
    RandomWords: 0.4.0
    requests: 2.32.3
    roman-numerals-py: 3.1.0
    scipy: 1.14.0
    setuptools: 78.1.0
    sfftk-rw: 0.8.1
    six: 1.16.0
    snowballstemmer: 3.0.1
    sortedcontainers: 2.4.0
    soupsieve: 2.7
    Sphinx: 8.2.3
    sphinx-autodoc-typehints: 3.1.0
    sphinxcontrib-applehelp: 2.0.0
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 2.0.0
    sphinxcontrib-htmlhelp: 2.1.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 2.0.0
    sphinxcontrib-serializinghtml: 2.0.0
    stack-data: 0.6.3
    superqt: 0.7.1
    tables: 3.10.2
    tcia_utils: 1.5.1
    tifffile: 2025.3.13
    tinyarray: 1.2.4
    tornado: 6.5.1
    traitlets: 5.14.3
    typing_extensions: 4.14.0
    tzdata: 2025.2
    urllib3: 2.5.0
    wcwidth: 0.2.13
    webcolors: 24.11.1
    wheel: 0.45.1
    wheel-filename: 1.4.2
    widgetsnbextension: 4.0.14
}}}
"	defect	closed	normal		Window Toolkit		duplicate						all	ChimeraX
