[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
>
> _______________________________________________
> phenixbb mailing list
> phenixbb at phenix-online.org
> http://www.phenix-online.org/mailman/listinfo/phenixbb
>   


-- 
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
*                Huanwang Yang  Ph.D.                      *
* RCSB Protein Data Bank                                   *
* Dep. of Chemistry & Chemical Biology, Rutgers University *
* 610 Taylor Road, Piscataway, NJ 08854-8087               *
* Phone: (732)-445-0103 (ext 240);  Fax: (732)-445-4320    *
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