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Ligand · V57

V57 · 7-{[3-({[2-(pyridin-2-yl)ethyl]amino}methyl) phenoxy]methyl}quinolin-2-amine

V57, 7-{[3-({[2-(pyridin-2-yl)ethyl]amino}methyl) phenoxy]methyl}quinolin-2-amine (C24 H24 N4 O, 384.5 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…

Component
V57
Formula
C24 H24 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

V57 in 2 structures; the first of them:

  • 6XK6 · Nitric Oxide Synthase from Bacillus subtilis in complex with… · V57 A902 · binds ILE218, PHE235, TRP238, TYR239, MET240, GLU243, ARG247, THR328 and 1 more
  • 6XK6 · Nitric oxide synthase from bacillus subtilis in complex with 7-((3… · V57 A902 · binds ILE218, PHE235, TRP238, TYR239, MET240, GLU243, ARG247, THR328 and 1 more

Residues it binds most

TRP 2, ARG 2, GLU 2, ILE 2, MET 2, PHE 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • CL · Chloride ion
  • GOL · Glycerol

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