[phenixbb] Anisotropy with TLS

Eugene Osipov e.m.osipov at gmail.com
Wed May 30 23:49:04 PDT 2018

Hi, everyone,
Can someone shed a light on B-factor refinement in PHENIX.refine.
I am refining the structure with 2.5 A resolution, with individual
B-factors and automatically defined TLS groups. Despite isotropic
refinement of B-factors I still see ANISOU entries for atoms.
I figured out that these ANISOU lines appear only after TLS refinement.
So the question is how these ANISOU values are calculated?

Eugene Osipov
Junior Research Scientist
Laboratory of Enzyme Engineering
A.N. Bach Institute of Biochemistry
Russian Academy of Sciences
Leninsky pr. 33, 119071 Moscow, Russia
e-mail: e.m.osipov at gmail.com
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://phenix-online.org/pipermail/phenixbb/attachments/20180531/7feb6f3c/attachment.htm>

More information about the phenixbb mailing list