GL1X · GenesisL1 explorer

Ligand · 56M

56M · 4-acetyl-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide

56M, 4-acetyl-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide (C19 H25 N3 O5 S, 407.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
56M
Formula
C19 H25 N3 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

56M in 2 structures; the first of them:

  • 5D25 · First bromodomain of BRD4 bound to inhibitor XD27 · 56M A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LYS91, LEU92, LEU94 and 5 more
  • 5D25 · First bromodomain of BRD4 bound to inhibitor XD27 · 56M A201 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LYS91, LEU92, LEU94 and 5 more

Residues it binds most

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

Found with

  • BU3 · (R,R)-2,3-butanediol
  • GOL · Glycerol

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