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Ligand · PU8

PU8 · 9-butyl-8-(2-chloro-3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine

PU8, 9-butyl-8-(2-chloro-3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine (C19 H24 Cl N5 O3, 405.9 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 residues…

Component
PU8
Formula
C19 H24 Cl N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

PU8 in 2 structures; the first of them:

  • 1UYD · Human Hsp90-alpha with 9-Butyl-8-(2-chloro-3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine · PU8 A1224 · binds ASN51, SER52, ALA55, ASP93, GLY97, MET98, LEU103, LEU107 and 7 more
  • 1UYD · Human HSP90-alpha with 9-butyl-8-(2-chloro-3,4,5-trimethoxy-benzyl)- 9H-purin-6-ylamine · PU8 A1224 · binds ASN51, SER52, ALA55, ASP93, GLY97, MET98, LEU103, LEU107 and 7 more

Residues it binds most

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

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