7QBM
Structure of the activation intermediate of cathepsin K in complex with the 3-cyano-3-aza-beta-amino acid inhibitor Gu2602
Summary for 7QBM
Entry DOI | 10.2210/pdb7qbm/pdb |
Descriptor | Cathepsin K, ~{tert}-butyl ~{N}-[iminomethyl-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]amino]carbamate, ACETATE ION, ... (6 entities in total) |
Functional Keywords | cathepsin k, protease inhibitor, cyanohydrazide warhead, azadipeptide nitrile, hydrolase |
Biological source | Homo sapiens (human) More |
Total number of polymer chains | 2 |
Total formula weight | 33063.61 |
Authors | Benysek, J.,Busa, M.,Mares, M. (deposition date: 2021-11-19, release date: 2022-01-26, Last modification date: 2024-01-31) |
Primary citation | Benysek, J.,Busa, M.,Rubesova, P.,Fanfrlik, J.,Lepsik, M.,Brynda, J.,Matouskova, Z.,Bartz, U.,Horn, M.,Gutschow, M.,Mares, M. Highly potent inhibitors of cathepsin K with a differently positioned cyanohydrazide warhead: structural analysis of binding mode to mature and zymogen-like enzymes. J Enzyme Inhib Med Chem, 37:515-526, 2022 Cited by PubMed: 35144520DOI: 10.1080/14756366.2021.2024527 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.88 Å) |
Structure validation
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