[phenixbb] difference in B factor for NCS groups

James Whittle whittle at MIT.EDU
Fri Aug 21 08:17:31 PDT 2009


Dear all,

I'm working with a structure were one NCS copy has significantly high  
B-factors than the other. That one copy makes few crystal contacts to  
stabilize it.

Is there a recommended way to adjust the refinement to reflect  
this ... using TLS? Decreasing b_factor_weight? Is there a way refine  
a group_b to be added to the b-factor of each atom in that chain?

--James



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