[phenixbb] Metal Coordination and symmetry operation
alex.theodossis at monash.edu
Tue Oct 16 18:33:40 PDT 2012
> Dear bb,
> I am trying to refine a Zn ion coordinated by symmetry related residues.
> To avoid groups being pushed away. I have use phenix.metal_coordination to
> generate the necessary link edits. However only non-symmetry related
> interactions are accounted for. Is there a relevant option I can switch on?
> Alternatively, does anyone have an example of the syntax required to
> define the necessary symmetry operations in the elbow.edits file?
> Thanks in advance.
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