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-Structure paper
Title | Trifluoromethylphenyl as P2 for ketoamide-based cathepsin S inhibitors. |
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Journal, issue, pages | Bioorg. Med. Chem. Lett., Vol. 20, Page 6890-6894, Year 2010 |
Publish date | Sep 17, 2010 (structure data deposition date) |
![]() | Cai, J. / Robinson, J. / Belshaw, S. / Everett, K. / Fradera, X. / van Zeeland, M. / van Berkom, L. / van Rijnsbergen, P. / Popplestone, L. / Baugh, M. ...Cai, J. / Robinson, J. / Belshaw, S. / Everett, K. / Fradera, X. / van Zeeland, M. / van Berkom, L. / van Rijnsbergen, P. / Popplestone, L. / Baugh, M. / Dempster, M. / Bruin, J. / Hamilton, W. / Kinghorn, E. / Westwood, P. / Kerr, J. / Rankovic, Z. / Arbuckle, W. / Bennett, D.J. / Jones, P.S. / Long, C. / Martin, I. / Uitdehaag, J.C. / Meulemans, T. |
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Methods | X-ray diffraction |
Resolution | 1.49 - 2.02 Å |
Structure data | ![]() PDB-3ovx: ![]() PDB-3ovz: |
Chemicals | ![]() ChemComp-O64: ![]() ChemComp-DMS: ![]() ChemComp-HOH: ![]() ChemComp-O96: ![]() ChemComp-SO4: |
Source |
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![]() | HYDROLASE/HYDROLASE INHIBITOR / Cathepsin S / Hydrolase / Covalent inhibitor / aldehyde warhead / Ligand is covalently bound to Cys25 / Lysosomeal protein / HYDROLASE-HYDROLASE INHIBITOR complex / Cathepsin K / ketoamide warhead / Ligand forms covalent bond to Cys25 / Lysosomes |