11 Aug
2014
11 Aug
'14
1:51 p.m.
On 8/11/14, 1:20 PM, flavio seixas wrote: > I was trying to make a restriction to generate a covalent bond between > NZ atom from Lisine with C4 atom of PLP cofator. > I search Manual and modeler-List to find some clues about how to do
If you want to make a distance restraint (this is what your restraints file is trying to do) between those two atoms, then see http://salilab.org/modeller/9.14/manual/node28.html
If you really want to make a covalent bond, you'll need to write a suitable CHARMM patch: see the CHARMM manual. You can then apply it like the existing DISU patch: http://salilab.org/modeller/9.14/manual/node24.html
Ben Webb, Modeller Caretaker
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