[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

Re: [modeller_usage] restrain beta strands and plates



Arnout Voet wrote:
i have met a problem in my scripting to restrain the secondary structure
element beta sheet beta strand.
For alpha helices it works and i see an influence on the modelled
structure , however for sheets it does not work and i get the same model
with or without the restraining in the script.

You should make sure you are using the latest version of Modeller. Versions before 7v7 had a bug in the strand code, so would not restrain sheets or strands correctly.

Note that if your beta restraints conflict with other restraints (e.g. template information) then Modeller will attempt to satisfy _all_ restraints as best it can, and consequently may not honor your beta restraints fully. You should remove conflicting restraints (e.g. by unaligning your sequence from the templates) in this case.

	Ben Webb, Modeller Caretaker
--
             http://www.salilab.org/modeller/
Modeller mail list: http://salilab.org/mailman/listinfo/modeller_usage