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Ligand · A91

A91 · 3-({2-[(2-amino-6-methylpyrimidin-4-yl)ethynyl]benzyl}amino)-1,3-oxazol-2(3H)-one

A91, 3-({2-[(2-amino-6-methylpyrimidin-4-yl)ethynyl]benzyl}amino)-1,3-oxazol-2(3H)-one (C17 H15 N5 O2, 321.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
A91
Formula
C17 H15 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

A91 in 2 structures; the first of them:

  • 2QG2 · HSP90 complexed with A917985 · A91 A300 · binds ASN51, SER52, ALA55, ASP93, ILE96, GLY97, MET98, LEU103 and 9 more
  • 2QG2 · HSP90 complexed with A917985 · A91 A300 · binds ASN51, SER52, ALA55, ASP93, ILE96, GLY97, MET98, LEU103 and 9 more

Residues it binds most

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

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