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Re: [ccp4bb]: Program to analyse bondlenght and angles rmsds?
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Quoting Florian Schmitzberger <florian@cryst.bioc.cam.ac.uk>:
> Dear All,
>
> I would be interested in a program to calculate rms deviations from ideal
> geometry for angles and bondlenght. I get this information easily when I
> refine my own structures. However I don't know a progam with which to
> obtain this information, when I for instance want to analyse a pdb (from
> the pdb-databank; when I don't have reflection files to use a standard
> refinement program to do this job). Whatcheck gives me the RMSD in
> Z-scores, but I would also like to have the absolute values of the
> rmsds.
>
> Any comments greatly appreciated.
>
> Thank you,
>
> Florian
>
> -------------------------------------
> Florian Schmitzberger
> University of Cambridge
> Department of Biochemistry
> 80 Tennis Court Road
> CB2 1GA Cambridge
> Tel: 0044-1223-766029
You can use for instance whatif
http://www.cmbi.kun.nl/gv/whatif/
or run it remotely
http://biotech.embl-heidelberg.de:8400/
Lari Lehtiö
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University of Helsinki
Institute of Biotechnology
Macromolecular X-ray crystallography
P.O.Box 65
00014 HY
Finland
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