[phenixbb] NCS restraints

Rife, Christopher L crife at slac.stanford.edu
Thu May 22 13:27:45 PDT 2008


I'm refining a twinned structure at 2.2A that has 6 copies in the ASU. I am using NCS, however the ncs restraints are so tight that they are keeping the chains identical even though this takes them out of the density. Are there any parameters I can adjust that will lessen the strength of these restraints? Taking away NCS completely is also not ideal. I guess I would like an equivalent of 'medium' or 'loose' NCS restraints as implemented in Refmac.

Thanks,
Chris




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