Ralf W. Grosse-Kunstleve
rwgk at cci.lbl.gov
Fri May 23 09:27:50 PDT 2008
> Should phenix.refine be able to handle OXT?
> I find it is moving the OXT atom ~2A from where it should be.
This shouldn't happen unless the atoms the OXT is bonded to are missing
and it is floating around in isolation.
Could you check the OXT bonds in the .geo file? (I hope it is obvious.)
If you send me the fragment of our PDB file with the terminus and maybe
a few residues before that I'll take a look.
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