[Chimera-users] question on protein structure change after matchmaker (position-change) operation
Lei Qian
leiqian at temple.edu
Mon Sep 27 10:06:59 PDT 2021
Hi Elaine,
Thank you very much for your explanation!
Best,
Lei
________________________________
From: Elaine Meng <meng at cgl.ucsf.edu>
Sent: Monday, September 27, 2021 12:11 AM
To: Lei Qian <leiqian at temple.edu>
Cc: chimera-users at cgl.ucsf.edu <chimera-users at cgl.ucsf.edu>
Subject: Re: [Chimera-users] question on protein structure change after matchmaker (position-change) operation
Hi Lei,
Matchmaker itself does not change the structure. However, if you save a PDB file after moving any atomic structure (by any method), because of rounding you may get tiny differences comparing the structures before and after. PDB file format only has 3 digits after the decimal in X,Y,Z coordinates.
Best,
Elaine
-----
Elaine C. Meng, Ph.D.
UCSF Chimera(X) team
Department of Pharmaceutical Chemistry
University of California, San Francisco
> On Sep 25, 2021, at 10:17 AM, Lei Qian via Chimera-users <chimera-users at cgl.ucsf.edu> wrote:
>
> Dear users,
> After aligning protein A to protein B using matchmaker, I found the protein A structure slightly changed compared with its original structure (RMSD: 0.001).
> Could I ask how I can keep protein A structure unchanged after matchmaker (position-change) operation?
> Thanks!
> Lei
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