[phenixbb] heavy atom sites in autobuild
Bryan W. Lepore
bryanlepore at mail.utexas.edu
Fri Dec 28 15:14:48 PST 2007
i'm confused about treatment of heavy atom sites in autobuild. couple
questions :
1. since heavy atom sites can be treated as single atoms, should
phenix.autobuild simply refine the positions within a protein model? i.e.
heavy atom sites should not need to be treated as ligands, with a .cif --
right?
2. if i want autobuild to build around the heavy atom site, can i just
use input_pdb_file=heavy.pdb? input_lig_file_list= is not working.
-bryan
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