[phenixbb] SIR with sites from SAD?
Francis E Reyes
Francis.Reyes at Colorado.EDU
Thu Jul 17 07:54:49 PDT 2008
I have a SAD dataset where autosol was able to find sites, but the
resulting density modified map was uninterpretable. The unit cell for
this SAD set was Unit cell: (53.2373, 53.2373, 186.446, 90, 90, 90)
.
I now have a heavy atom derivative. What's the format of autosol.inp
(to be passed to phenix.runWizard AutoSol) that allows me to use the
heavy atom sites from the SAD set as a basis for helping find heavy
atom sites in the heavy atom derivative? Is it the same as SIR, except
use ha_sites_file for the SAD solution?
Native unit cell: [53.155600000000007, 53.1556000
00000007, 187.37970000000001, 90.0, 90.0, 90.0
Derivative unit cell: [53.1
82299999999998, 53.182299999999998, 187.59569999999999, 90.0, 90.0,
90.0].
Thanks
FR
---------------------------------------------
Francis Reyes M.Sc.
215 UCB
University of Colorado at Boulder
gpg --keyserver pgp.mit.edu --recv-keys 67BA8D5D
8AE2 F2F4 90F7 9640 28BC 686F 78FD 6669 67BA 8D5D
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