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Ligand · V5G

V5G · 7-({3-[2-(6-aminopyridin-2-yl)ethyl]phenoxy}methyl) quinolin-2-amine

V5G, 7-({3-[2-(6-aminopyridin-2-yl)ethyl]phenoxy}methyl) quinolin-2-amine (C23 H22 N4 O, 370.5 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
V5G
Formula
C23 H22 N4 O
Class
ligand
Structures
5
PDB entries
4

Binding sites

V5G in 5 structures; the first of them:

  • 6XK7 · Nitric Oxide Synthase from Bacillus subtilis in complex with… · V5G A902 · binds PRO216, ILE218, PHE235, GLY237, TRP238, TYR239, MET240, GLU243 and 3 more
  • 7S3Y · Structure ofrat neuronal nitric oxide synthase heme domain in complex with… · V5G A803 · binds PRO565, VAL567, ASN569, MET570, PHE584, GLY586, TRP587, TYR588 and 6 more
  • 6XK7 · Nitric oxide synthase from bacillus subtilis in complex with 7-((3-(2… · V5G A902 · binds ILE218, PHE235, TRP238, TYR239, GLU243, ARG247, THR328, TRP329
  • 6XMC · Nitric oxide synthase from bacillus subtilis in complex with 7-((3-(2… · V5G A902 · binds ILE218, PHE235, TRP238, TYR239, GLU243, ARG247, THR328, TRP329
  • 7M56 · Structure of human endothelial nitric oxide synthase heme domain in complex with… · V5G A503 · binds PRO334, VAL336, ASN338, MET339, TRP356, TYR357, MET358, GLU361 and 2 more

Residues it binds most

TRP 8, TYR 7, MET 5, GLU 7, PHE 6, PRO 5, GLN 4, VAL 5, ARG 4, ASN 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • GOL · Glycerol
  • CL · Chloride ion
  • POL · N-propanol
  • H4B · 5,6,7,8-tetrahydrobiopterin
  • ZN · Zinc ion
  • ACT · Acetate ion
  • GD · Gadolinium atom
  • BTB · 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol

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