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Ligand · XJG

XJG · 1,3-dihydroisoindol-2-yl-(2-hydroxy-4-methoxy-5-propan-2-yl-phenyl)methanone

XJG, 1,3-dihydroisoindol-2-yl-(2-hydroxy-4-methoxy-5-propan-2-yl-phenyl)methanone (C19 H21 N O3, 311.4 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
XJG
Formula
C19 H21 N O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

XJG in 2 structures; the first of them:

  • 2XJG · Structure of HSP90 with small molecule inhibitor bound · XJG A1224 · binds LEU48, ASN51, SER52, ASP54, ALA55, LYS58, ILE91, ASP93 and 9 more
  • 2XJG · Structure of HSP90 with small molecule inhibitor bound · XJG A1224 · binds LEU48, ASN51, SER52, ASP54, ALA55, LYS58, ILE91, ASP93 and 9 more

Residues it binds most

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

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