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Ligand · H8B

H8B · 7-[[2-(methylaminomethyl)phenoxy]methyl]quinolin-2-amine

H8B, 7-[[2-(methylaminomethyl)phenoxy]methyl]quinolin-2-amine (C18 H19 N3 O, 293.4 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
H8B
Formula
C18 H19 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

H8B in 2 structures; the first of them:

  • 5G6G · Structure of Bacillus subtilis Nitric Oxide Synthase in complex with… · H8B A1367 · binds HIS128, GLN129, ARG132, PRO216, ILE218, ASP220, MET221, PHE235 and 7 more
  • 5G6G · Structure of bacillus subtilis nitric oxide synthase in complex with… · H8B A1367 · binds HIS128, GLN129, ARG132, PRO216, ILE218, ASP220, MET221, PHE235 and 7 more

Residues it binds most

MET 2, TRP 2, TYR 2, ARG 2, ASP 2, GLN 2, GLU 2, GLY 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • CL · Chloride ion

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