On 09/11/2022 13:59, Deepak Deepak wrote:
Dear CCP4 users,
I am working towards solving a protein-ligand complex structure. The
ligand is 5.2 kDa (495 atoms) and made of 3 distinctive repetitive
monomers. [...]
I will happily provide more information if I am missing something here.
You're
Dear CCP4 users,
I am working towards solving a protein-ligand complex structure. The ligand
is 5.2 kDa (495 atoms) and made of 3 distinctive repetitive monomers. I
have a PDB model for the ligand and also as smiles and mol2 format.
I tried generating restraint files for this ligand using Jligand,
