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Ligand · N9T

N9T · (1~{R},3~{S})-~{N}-(6,7-dimethoxy-2-oxidanylidene-chromen-3-yl)-3-[(phenylmethyl)amino]cyclohexane-1-carboxamide

N9T, (1~{R},3~{S})-~{N}-(6,7-dimethoxy-2-oxidanylidene-chromen-3-yl)-3-[(phenylmethyl)amino]cyclohexane-1-carboxamide (C25 H28 N2 O5, 436.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
N9T
Formula
C25 H28 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

N9T in 2 structures; the first of them:

  • 6TT0 · Crystal structure of a potent and reversible dual binding site Acetylcholinesterase… · N9T A601 · binds TYR70, ASP72, TRP84, GLY117, GLY118, TYR121, GLU199, TRP279 and 6 more
  • 6TT0 · Crystal structure of a potent and reversible dual binding site acetylcholinesterase… · N9T A601 · binds TYR70, ASP72, TRP84, GLY118, TYR121, GLU199, TRP279, PHE330 and 3 more

Residues it binds most

TYR 2, PHE 2, GLY 2, TRP 2, ASP 2, GLU 2, HIS 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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