[phenixbb] phenix.real_space_refine - Removing rotamer restraints on a per residue basis

Oleg Sobolev osobolev at lbl.gov
Mon Jun 25 11:33:09 PDT 2018


Hi Ashley,

I'm afraid it is not possible to remove rotamer restraints on per-residue
basis currently.

Best regards,
Oleg Sobolev.

On Mon, Jun 25, 2018 at 8:24 AM, Ashley Pike <ashley.pike at sgc.ox.ac.uk>
wrote:

> Hi,
>
> Is it possible to exclude particular residues from the effects of global
> restraints in phenix.real_space_refine? In my case rotamer restraints mucks
> up the sidechain fit to density for certain Phe and Tyr?.
>
>
>
> Thanks,
>
> Ashley
>
>
>
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