[phenixbb] h_bonds restraints
Pavel Afonine
PAfonine at lbl.gov
Sat Mar 27 17:01:12 PDT 2010
Hi Maia,
not sure if it makes sense to me, but anyway, technically you can do
that: just define a custom bond between these two atoms as described in:
http://www.phenix-online.org/version_docs/1.6.1-353/refinement.htm#anch80
And to make sure phenix.refine doesn't remove any of these two waters,
run it with "ordered_solvent=true".
Pavel.
On 3/27/10 4:55 PM, Maia Cherney wrote:
> Pavel,
> I just want to restrain the distance between 2 particular waters. Is
> it in the pdb_interpretation?
> Maia
>
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