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Ligand · 2NJ

2NJ · (4S)-1-methyl-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one

2NJ, (4S)-1-methyl-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one (C16 H16 N2 O, 252.3 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…

Component
2NJ
Formula
C16 H16 N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

2NJ in 2 structures; the first of them:

  • 4PCI · Crystal Structure of the first bromodomain of BRD4 in complex with B16 · 2NJ A201 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, TYR139 and 2 more
  • 4PCI · Crystal structure of the first bromodomain of BRD4 in complex with B16 · 2NJ A201 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, TYR139 and 2 more

Residues it binds most

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

Found with

  • EDO · 1,2-ethanediol

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