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Ligand · 40Z

40Z · 2-chloro-5-(furan-2-ylmethyl)-8,11,11-trimethyl-9-oxo-6,7,9,10,11,12-hexahydro-5H-indolo[1,2-a][1,5]benzodiazepine-3-carboxamide

40Z, 2-chloro-5-(furan-2-ylmethyl)-8,11,11-trimethyl-9-oxo-6,7,9,10,11,12-hexahydro-5H-indolo[1,2-a][1,5]benzodiazepine-3-carboxamide (C25 H26 Cl N3 O3, 451.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
40Z
Formula
C25 H26 Cl N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

40Z in 2 structures; the first of them:

  • 4XIT · Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock… · 40Z A301 · binds ASN51, SER52, ALA55, LYS58, ASP93, MET98, ASP102, LEU103 and 9 more
  • 4XIT · Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock… · 40Z A301 · binds ASN51, SER52, ALA55, LYS58, ASP93, MET98, ASP102, LEU103 and 9 more

Residues it binds most

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

Found with

  • GOL · Glycerol

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