[phenixbb] Chirality of Ribityl chain of FMN inverted

Bryan Lepore bryanlepore at gmail.com
Thu Oct 13 12:47:33 PDT 2011


> On Thu, Oct 13, 2011 at 11:41 AM, Yuri <yuri.pompeu at ufl.edu> wrote:
>> When I built Ligand restraints using eLBOW, my resulting .pdb had an
>> inverted chiral center

i suspect a pdb code was used.

i worked around the same problems with another cofactor specifying the
chirality using smiles strings.

you have to double-check it anyways.

-Bryan


More information about the phenixbb mailing list