Re: [COOT] Sekvence Alignmutate

2014-11-13 Thread Tim Gruene
Dear Jan, in principle you can (ab-)use the program mrtailor for this purpose. You provide the PDB file, the sequence alignment (the way you want it to be aligned) and it will mutate only the mismatches and leave all other residues in the PDB file untouched. There is a command line option but

[COOT] Sekvence Alignmutate

2014-11-12 Thread Jan Stransky
Hi all, I have experienced strange behavior of Alignmutate tool. I wanted to correct few differences in sequence with it, and there is a place in the sequence looking like this: orginal sequence: XYZDSUVW new sequence: XYZSPUVW which ends after Alignmutate like this: XYZDS-UVW XYZ-SPUVW and

Re: [COOT] Sekvence Alignmutate

2014-11-12 Thread Oliver Clarke
Hi Jan, One of the little extensions I have written for coot (which you can download from: https://www.dropbox.com/s/0b4bebwxw0p9x0e/oli_custom.py?dl=0 or at cootscripts.tiddlyspace.com), might be handy for this (in the script it is the function mutate_by_resnum). It does not align the