GL1X · GenesisL1 explorer

Ligand · 559

559 · 5-[(4S)-6-(4-chlorophenyl)-1,4-dimethyl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-8-yl]pyridin-2-amine

559, 5-[(4S)-6-(4-chlorophenyl)-1,4-dimethyl-5,6-dihydro-4H-[1,2,4]triazolo[4,3-a][1,5]benzodiazepin-8-yl]pyridin-2-amine (C23 H21 Cl N6, 416.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
559
Formula
C23 H21 Cl N6
Class
ligand
Structures
2
PDB entries
1

Binding sites

559 in 2 structures; the first of them:

  • 4Z1S · Crystal structure of the first bromodomain of human BRD4 with benzotriazolo-diazepine… · 559 A201 · binds TRP81, PRO82, PHE83, VAL87, LYS91, LEU92, LEU94, TYR97 and 6 more
  • 4Z1S · Crystal structure of the first bromodomain of human BRD4 with benzotriazolo-diazepine… · 559 A201 · binds TRP81, PRO82, PHE83, VAL87, LYS91, LEU92, LEU94, TYR97 and 6 more

Residues it binds most

LEU 4, TYR 4, ASN 4, ASP 4, CYS 4, ILE 4, MET 4, PHE 4, PRO 4, TRP 4 (residue and the binding sites it lines).

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