[phenixbb] Alternative conformation on special position occupancy wrong
Kaiser, Jens T.
kaiser at caltech.edu
Wed May 20 07:23:07 PDT 2020
We have a case of a cofactor with 222 symmetry in two states on a special position ( 2-fold). When modelling one state, Phenix correctly restrains the occupancy to 0.5. When putting state 2 in alternative conformation group B, the occupancy of altconf A and B is restrained to 1.0, instead of 0.5; it seems like it does not recognize that the alternative conformations are on a special position.
Sent from Mail<https://go.microsoft.com/fwlink/?LinkId=550986> for Windows 10
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the phenixbb