[phenixbb] mmCIF format
Huanwang Yang
hyang at rcsb.rutgers.edu
Tue Sep 30 14:03:16 PDT 2008
Hi Simon
You can use the PDB tools (pdb_extract: http://pdb-extract.rcsb.org/)
for deposition. pdb_extract can convert any structure factor formats to
mmcif. Also the program sf_convert
(http://sw-tools.pdb.org/apps/SF-CONVERT/doc/V1-0-00/documentation.html)
also serve the purpose.
Huanwang
Simon Kolstoe wrote:
> Is there a simple way of creating an mmCIF formatted structure factor
> file for pdb deposition from the outputs of a phenix.refine run?
>
> Thanks,
>
> Simon
>
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>
--
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* Huanwang Yang Ph.D. *
* RCSB Protein Data Bank *
* Dep. of Chemistry & Chemical Biology, Rutgers University *
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