[phenixbb] bond deviation deected by Coot
nechols at lbl.gov
Mon Dec 5 10:55:33 PST 2011
On Mon, Dec 5, 2011 at 6:44 AM, Dialing Pretty <hdc123hdc123 at yahoo.com> wrote:
> After Pheneix refine, the quality of the structure improved significantly as
> analyzed by Molprobity. However the bond deviation increased significantly
> after the refinement. Will you please tell me which refine function can be
> used to reduce the bond deviation detected by the Coot geometry analysis?
Optimize the X-ray/stereochemistry weight. What is the actual bond deviation?
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