[phenixbb] no shift with rigid body
Pavel Afonine
pafonine at lbl.gov
Mon Nov 3 09:30:09 PST 2008
Hi James,
could you send us the data and model so we can optimize our rigid body
refinement protocol even more to automatically handle cases like yours.
We promise to keep your data confidential. If you decide to send the
data, please send it to my address (not to the phenixbb).
Thanks!
Pavel.
On 11/3/2008 6:27 AM, James Whittle wrote:
> Hi-
>
> I'm trying to do rigid body refinement against 3.5 A SeMet data, using
> a rigid_body group for each helix in the protein. The log file and the
> pdb results both report shifts for each of the rigid body groups, yet
> the coordinates overlay perfectly with the input coordinates.
>
> Can any one suggest what I might be doing incorrectly?
>
> --James
>
>
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