Subject: Automated Peak Picking by APES
From: Arun Gupta
Date: Aug 2, 2017
Previous: 1245 Next: 1248
Hi Lee
I
recently tried Automated peak picking by APES in NMRFAM-Sparky for my
3D HSQC 3D HNCO spectrum after providing Amino acid sequence .txt
file ( 3 -letter amino acid code). Total number of amino acids in
protein sequence = 168. However repeatedly I am getting this same
error message.
Exception in Tkinter callbackTraceback (most
recent call last):
File
C:Program Filesnmrfam-sparky-win32pythonlib-tkTkinter.py,
line 1489, in __call__
return
self.func(*args)
File
C:Program Filesnmrfam-sparky-win32pythonsparkyapes.py,
line 380, in pick_cb
self.make_sequence_filter()
File
C:Program Filesnmrfam-sparky-win32pythonsparkyapes.py,
line 216, in make_sequence_filter
atms =
atomnames.protein_atoms_by_group_2[seq]
KeyError: X
Plz suggest solution
Regards
Arun Gupta