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Ligand · 40Y

40Y · 8,11,11-trimethyl-9-oxo-6,7,9,10,11,12-hexahydroindolo[2,1-d][1,5]benzoxazepine-3-carboxamide

40Y, 8,11,11-trimethyl-9-oxo-6,7,9,10,11,12-hexahydroindolo[2,1-d][1,5]benzoxazepine-3-carboxamide (C20 H22 N2 O3, 338.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
40Y
Formula
C20 H22 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

40Y in 2 structures; the first of them:

  • 4XIQ · Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock… · 40Y A301 · binds ASN51, SER52, ALA55, ASP93, MET98, ASP102, LEU103, LEU107 and 7 more
  • 4XIQ · Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock… · 40Y A301 · binds ASN51, SER52, ALA55, ASP93, MET98, ASP102, LEU103, LEU107 and 7 more

Residues it binds most

ALA 2, ASP 2, LEU 2, ASN 2, GLY 2, MET 2, PHE 2, SER 2, THR 2, TRP 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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