[chimerax-users] Specify unmodelled residues

Elaine Meng meng at cgl.ucsf.edu
Fri Dec 9 14:12:35 PST 2022


Hello Matt,
The full sequence of what was used in the experiment (crystallography, NMR, ...)  comes from the SEQRES records in a PDB file:
<https://www.wwpdb.org/documentation/file-format-content/format33/sect3.html#SEQRES>

Those residues included in the SEQRES but without corresponding atomic coordinates will automatically be shown with the black outline box in the sequence window.  If you open a PDB file that doesn't have SEQRES records, the sequence window will only reflect what was read from the coordinates.

I hope this helps,
Elaine
-----
Elaine C. Meng, Ph.D.                       
UCSF Chimera(X) team
Department of Pharmaceutical Chemistry
University of California, San Francisco


> On Dec 9, 2022, at 11:47 AM, Jaremko, Matt Joseph via ChimeraX-users <chimerax-users at cgl.ucsf.edu> wrote:
> 
> Hello ChimeraX Team,  
> What information in the PDB file specifies the unmodelled residues (in black box)?:
> 
> <image001.png>
>  
> I’d like to have this information in my own PDB files.
> Thank you,
> Matt




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