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Re: artificial B factors from NMR structures
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On Mon, 25 Oct 1999, Yu Wai Chen wrote:
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> Hi,
>
> Can anyone tell me what program I can use to compute artificial
> temperature factors for a NMR structure based on rmsd of the average
> structure? Thanks.
>
> Wai
Hello Wai,
have a look at:
Wilmanns & Nilges, Acta Cryst (1996) D52:973-982
Molecular Replacement with NMR Models Using Distance-Derived
Pseudo B Factors
and also at:
http://imsb.au.dk/~mok/o/ofaq/Q.879.html
-> ftp://alpha2.bmc.uu.se/pub/gerard/omac/multi_probe
Concerning the Wilmanns & Nilges method, I have written a Perl program
which will do the job - send me a message if you are interested.
Hope this helps, good luck - Luca