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Ligand · IHI

IHI · 9-cyclopentyl-6-[2-(3-imidazol-1-yl-propoxy)-phenylamino]-9H-purine-2-carbonitrile

IHI, 9-cyclopentyl-6-[2-(3-imidazol-1-yl-propoxy)-phenylamino]-9H-purine-2-carbonitrile (C23 H24 N8 O, 428.5 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
IHI
Formula
C23 H24 N8 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

IHI in 2 structures; the first of them:

  • 1U9W · Crystal Structure of the Cysteine Protease Human Cathepsin K in Complex with the Covalent… · IHI A300 · binds GLN19, GLY23, SER24, CYS25, TRP26, CYS63, GLY64, GLY65 and 8 more
  • 1U9W · Crystal structure of the cysteine protease human cathepsin K in complex with the covalent… · IHI A300 · binds GLN19, GLY23, SER24, CYS25, TRP26, CYS63, GLY64, GLY65 and 8 more

Residues it binds most

GLY 2, ALA 2, CYS 2, LEU 2, ASN 2, GLN 2, HIS 2, SER 2, TRP 2, TYR 2 (residue and the binding sites it lines).

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