[phenixbb] questions on refinement

Pavel Afonine pafonine at lbl.gov
Fri Feb 18 09:37:28 PST 2011

  Hi Hena,

the answer to your question:

This should be available in *development* version of PHENIX, dev-673:


which is not officially released.
You can do it in Coot too.

Let me know if you have any questions.


On 2/18/11 9:12 AM, Hena Dutta wrote:
> Hello,
> I have a question on refinement of macromolecules. I like to apply 180 
> degree rotation to the side chain of a particular residue about a 
> particular bond and see, which one (before or after applying rotation) 
> agrees well with the observed x-ray data (based on R factors and 
> electron density map). Can someone advise, what could be the best way 
> to do this? I like to do the same operation on multiple structures 
> which are already refined.
> Regards,
> hena

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://phenix-online.org/pipermail/phenixbb/attachments/20110218/5ac8541f/attachment-0003.htm>

More information about the phenixbb mailing list