CNS molecular replacement using NMR models

Yu Wai Chen ywc at
Mon Oct 25 09:30:32 EST 1999

Dear all,

I would like to try using a whole NMR ensamble as a search model in CNS

I should expect to meet a lot of problems with short atomic distances
when I try to generate molecular structure files from such an ensamble
(same atom identity with different segment ids for each model).  I have
been thinking of generating alternative conformations for all atoms with
the alternate.inp task file but just wnoder if there are better
alternatives around.  Can someone help me?
Yu Wai CHEN, Ph.D. ..................   email:ywc at
 Centre for Protein Engineering,             tel:+44-(0)1223-402148
 MRC Centre, Hills Rd, Cambridge CB2 2QH, UK fax:+44-(0)1223-402140
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