[phenixbb] xtriage to double-check symmetry
Frank von Delft
frank.vondelft at sgc.ox.ac.uk
Thu Sep 17 02:19:05 PDT 2009
We were trying to decide whether a structure is P65 or P6522: data
merges fine in latter, and NCS is perfect, but R/Rfree are significantly
worse (32/37-ish vs 23/28 for P65).
So I thought I'd listen to xtriage: seemed easy since I have both data
and model in P6522, and I ran:
phenix.xtriage final.mtz reference.structure.file=final.pdb
I'm not sure it's done anything, though - at least, I can't find the
table shown on the 4th-last slide of this presentation:
Something I said / did not say? Do I *have* to run it in P1?
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