[phenixbb] bgroup refinement of ZN ions

Ursula Schulze-Gahmen uschulze-gahmen at lbl.gov
Mon Nov 13 13:10:14 PST 2017

I have 2 Zn ions which are defined as HETATM, in my structure. I am using
tls and bgroup refinement for the whole structure. It seems like the Zn
ions are treated as one group. They always have the same B-value. I would
like to refine the B-value of the ZN ions separately, but refine the rest
of the structure with bgroup refinement. Is that possible? How would I do


Ursula Schulze-Gahmen, Ph.D.
Project Scientist
UC Berkeley, QB3
360 Stanley Hall #3220
Berkeley, CA 94720-3220
(510) 643 9491
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