Ligand · 8VJ

8VJ · 7-[[4-[(dimethylamino)methyl]phenoxy]methyl]quinolin-2-amine

8VJ, 7-[[4-[(dimethylamino)methyl]phenoxy]methyl]quinolin-2-amine (C19 H21 N3 O, 307.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component: 8VJ
Formula: C19 H21 N3 O
Class: ligand
Structures: 3
PDB entries: 3

Binding sites

8VJ in 3 structures; the first of them:

5G6N · Structure of Bacillus subtilis Nitric Oxide Synthase in complex with… · 8VJ A904 · binds HIS128, PRO216, ILE218, ASP220, MET221, PHE235, GLY237, TRP238 and 5 more
5G6O · Structure of Bacillus subtilis Nitric Oxide Synthase in complex with two molecules of… · 8VJ A904 · binds HIS128, PRO216, ILE218, ASP220, MET221, PHE235, GLY237, TRP238 and 4 more
5G6P · Structure of Bacillus subtilis Nitric Oxide Synthase I218V in complex with… · 8VJ A904 · binds HIS128, VAL218, ASP220, MET221, PHE235, GLY237, TRP238, TYR239 and 4 more

Residues it binds most

MET 3, TYR 3, TRP 5, ASP 3, GLU 3, GLY 3, HIS 3, PHE 3, ARG 2, ILE 2 (residue and the binding sites it lines).

Found with

HEM · Protoporphyrin IX containing Fe
CL · Chloride ion
GOL · Glycerol
H4B · 5,6,7,8-tetrahydrobiopterin
BTB · 2-[bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol

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