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-Structure paper
Title | 4-(3-Trifluoromethylphenyl)-pyrimidine-2-carbonitrile as cathepsin S inhibitors: N3, not N1 is critically important. |
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Journal, issue, pages | Bioorg. Med. Chem. Lett., Vol. 20, Page 4507-4510, Year 2010 |
Publish date | May 20, 2010 (structure data deposition date) |
Authors | Cai, J. / Fradera, X. / van Zeeland, M. / Dempster, M. / Cameron, K.S. / Bennett, D.J. / Robinson, J. / Popplestone, L. / Baugh, M. / Westwood, P. ...Cai, J. / Fradera, X. / van Zeeland, M. / Dempster, M. / Cameron, K.S. / Bennett, D.J. / Robinson, J. / Popplestone, L. / Baugh, M. / Westwood, P. / Bruin, J. / Hamilton, W. / Kinghorn, E. / Long, C. / Uitdehaag, J.C. |
External links | Bioorg. Med. Chem. Lett. / PubMed:20580231 |
Methods | X-ray diffraction |
Resolution | 1.6 Å |
Structure data | PDB-3n3g: |
Chemicals | ChemComp-PEG: ChemComp-DMS: ChemComp-935: ChemComp-93N: ChemComp-SO4: ChemComp-GOL: ChemComp-HOH: |
Source |
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Keywords | HYDROLASE / Cathepsin S / covalent inhibitor |