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Ligand · M68

M68 · 7-[2-[2-(3-chlorophenyl)ethylamino]ethyl]quinolin-2-amine

M68, 7-[2-[2-(3-chlorophenyl)ethylamino]ethyl]quinolin-2-amine (C19 H20 Cl N3, 325.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
M68
Formula
C19 H20 Cl N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

M68 in 2 structures; the first of them:

  • 4CAQ · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · M68 A800 · binds MET336, LEU337, PRO565, VAL567, PHE584, TRP587, TYR588, MET589 and 4 more
  • 4CAQ · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · M68 A800 · binds MET336, LEU337, PRO565, VAL567, PHE584, TRP587, TYR588, MET589 and 4 more

Residues it binds most

TRP 4, MET 4, TYR 4, GLU 4, PHE 4, PRO 4, VAL 4, LEU 2 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion
  • ACT · Acetate ion

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