GL1X · GenesisL1 explorer

Ligand · 666

666 · 6-(4-{[2-(3-iodobenzyl)-3-oxocyclohex-1-en-1-yl]amino}phenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one

666, 6-(4-{[2-(3-iodobenzyl)-3-oxocyclohex-1-en-1-yl]amino}phenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one (C24 H24 I N3 O2, 513.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
666
Formula
C24 H24 I N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

666 in 2 structures; the first of them:

  • 1SO2 · CATALYTIC DOMAIN OF HUMAN PHOSPHODIESTERASE 3B In COMPLEX WITH A DIHYDROPYRIDAZINE… · 666 A461 · binds TYR736, HIS737, THR829, LEU895, ILE938, GLY940, PRO941, HIS948 and 10 more
  • 1SO2 · Catalytic domain of human phosphodiesterase 3B in complex with a dihydropyridazine… · 666 A461 · binds TYR736, HIS737, THR829, LEU895, ILE938, GLY940, PRO941, HIS948 and 10 more

Residues it binds most

PHE 8, ILE 8, HIS 8, LEU 8, THR 8, GLN 8, GLY 8, PRO 8, SER 8, TRP 8 (residue and the binding sites it lines).

Found with

  • HG9 · 1-deoxy-1-[(2-hydroxyethyl)(nonanoyl)amino]hexitol
  • MG · Magnesium ion

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