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Ligand · EGN

EGN · 4-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-quinolin-2-one

EGN, 4-[2-(4-cyclohexylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1-ethyl-quinolin-2-one (C23 H32 N3 O2 S +1, 414.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
EGN
Formula
C23 H32 N3 O2 S +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

EGN in 2 structures; the first of them:

  • 6G0E · BRD4 (BD1) in complex with APSC-derived ligands · EGN A201 · binds TRP81, PRO82, PHE83, VAL87, LEU92, ASN93, LEU94, PRO95 and 6 more
  • 6G0E · BRD4 (BD1) in complex with apsc-derived ligands · EGN A201 · binds PRO82, PHE83, VAL87, LEU92, ASN93, LEU94, PRO95, ASP96 and 4 more

Residues it binds most

ASN 2, LEU 2, PRO 2, TYR 2, ASP 2, ILE 2, PHE 2, VAL 2, CYS 1, TRP 1 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • FMT · Formic acid
  • GOL · Glycerol

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