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PDBe Entry: 1vsn view

Crystal structure of a potent small molecule inhibitor bound to cathepsin K
Summary
Header Hydrolasesearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.0 Å, R-factor: 17.7%, Free R-factor: 20.9%, Spacegroup: P 21 21 21
Released 24/04/2007, deposition: 19/03/2007, last revision: 24/02/2009
Authors McGrath, M.search
Primary citation Identification of a potent and selective non-basic cathepsin K inhibitor.
BIOORG.MED.CHEM.LETT.search vol:16, pag:1985-1989 (2006) [PubMed ID 16413777 ]search
Keywords osteoporosissearch, structure-guided drug designsearch, proteaesearch, Hydrolasesearch
EC 3.4.22.38 ExPASy BRENDA search (A)
Organism Homo sapiens(human) 9606search(A)
UniProt Cathepsin K precursor (EC 3.4.22.38) (Cathepsin O) (Cathepsin X) (Cathepsin O2) P43235search (A)
Solvent A
Polymers
Id Name Type UniProt Residues Observed
A Cathepsin K Protein P43235 (CATK_HUMAN)search
215 100%
Heterogens
Id Name Ligands
A N-(2-AMINOETHYL)-N~2~-{(1S)-1-[4'-(AMINOSULFONYL)BIPHENYL-4-YL]-2,2,2-TRIFLUOROETHYL}-L-LEUCINAMIDE NFT search
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