[phenixbb] Histidine as a hydrogen bond acceptor in Phenix refine

Nathaniel Echols nechols at lbl.gov
Fri Sep 26 13:58:31 PDT 2014


On Fri, Sep 26, 2014 at 8:42 AM, Phan, Jason <jason.phan at vanderbilt.edu>
wrote:

> That made me think that Phenix does model hydrogen bonding interactions,
> just maybe not as consistently.
>

If this is happening it's entirely due to the way Reduce adds hydrogens -
the actual minimization in phenix.refine won't do anything special.

-Nat
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