[phenixbb] constrain insertion codes to unit occupancy?

van den Bedem, Henry vdbedem at slac.stanford.edu
Sat Oct 15 14:15:08 PDT 2016


I’m refining a site where there’s two compounds, each at partial occupancy. I modeled that using alt codes and insertion codes combined, like this

ATOM   6500  CA ACYS B 101B
ATOM   6490  CA BXXX B 101A

How can I constrain the occupancies so that they sum to unity? I tried several option, but the distinct insertions seem to refine independently. Sorry if a similar question has been posted before, but I could not find a solution searching phenixbb.


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