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Ligand · 22E

22E · 5,11-dimethyl-1-oxo-2,6-dihydro-1h-pyrido[4,3-b]carbazol-9-yl benzoate

22E, 5,11-dimethyl-1-oxo-2,6-dihydro-1h-pyrido[4,3-b]carbazol-9-yl benzoate (C24 H18 N2 O3, 382.4 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…

Component
22E
Formula
C24 H18 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

22E in 2 structures; the first of them:

  • 4AW2 · Crystal structure of CDC42 binding protein kinase alpha (MRCK alpha) · 22E A500 · binds ASP33, ILE36, LYS68, GLN69, ARG71, HIS73, LYS110, GLN145 and 4 more
  • 4AW2 · Crystal structure of CDC42 binding protein kinase alpha (mrck alpha) · 22E A500 · binds ASP33, ILE36, LYS68, GLN69, ARG71, HIS73, LYS110, GLN145 and 4 more

Residues it binds most

ASP 2, GLN 2, HIS 2, LYS 2, ARG 2, ILE 2, THR 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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