Hi, Generally if we use CCP4i we can find these details easily in scala log files.
Gauri On Thu, Jan 13, 2011 at 2:48 PM, J. Fleming <[email protected]> wrote: > Hi All, > > I'm about ready to deposit my structure and have used pdb_extract to aid > in the process. Unfortunately the following values were not found and are > required by ADIT: > > 1) Under Data Collection, Reflections section: Observed criterion sigma(F) > and Observed criterion sigma(I) > > 2) Under Refinement, Refinement Statistics section: Number unique > reflections (all) > > I looked in my log files for HKL2000, PHASER, and PHENIX but am confused on > where to find the required values above. I tried searching the logs for the > mmCIF items but that didn't help. Could someone point me the right > direction so I can deposit my structure with the correct values? > > Thanks in advance, > -Jon > > >
