[phenixbb] Refining sucrose

Yuri yuri.pompeu at ufl.edu
Mon May 23 07:55:15 PDT 2011


All coot needs to run its real-space refinement is a .cif file as Nigel 
pointed out.
You can also get this file from other ligand library websites (proDrg, 
hic-cup, etc...). The only catch here is. The name of your sucrose atoms 
must match, exactly, those in the file.
Once you have such file go to the the file drop-down menu and click on 
Import CIF dictionary in coot. That should enable to rotate the 
rotatable bonds of your ligand

-- 
Yuri Pompeu


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