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Ligand · 08K

08K · 8-chloro-1,4-dimethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,3,4]benzotriazepine

08K, 8-chloro-1,4-dimethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,3,4]benzotriazepine (C17 H14 Cl N5, 323.8 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…

Component
08K
Formula
C17 H14 Cl N5
Class
ligand
Structures
2
PDB entries
1

Binding sites

08K in 2 structures; the first of them:

  • 3U5L · Crystal Structure of the first bromodomain of human BRD4 in complex with a… · 08K A1 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, CYS136 and 5 more
  • 3U5L · Crystal structure of the first bromodomain of human BRD4 in complex with a… · 08K A1 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, CYS136 and 5 more

Residues it binds most

LEU 2, TYR 2, ASN 2, ASP 2, CYS 2, ILE 2, MET 2, PHE 2, PRO 2, TRP 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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