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-Structure paper
Title | Induced-Fit Binding of the Macrocyclic Noncovalent Inhibitor TMC435 to its HCV NS3/NS4A Protease Target |
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Journal, issue, pages | Angew. Chem. Int. Ed. Engl., Vol. 49, Page 1652-1655, Year 2010 |
Publish date | Oct 26, 2009 (structure data deposition date) |
Authors | Cummings, M.D. / Lindberg, J.D. / Lin, T.-I. / de Kock, H. / Lenz, O. / Lilja, E. / Fellander, S. / Baraznenok, V. / Nystrom, S. / Nilsson, M. ...Cummings, M.D. / Lindberg, J.D. / Lin, T.-I. / de Kock, H. / Lenz, O. / Lilja, E. / Fellander, S. / Baraznenok, V. / Nystrom, S. / Nilsson, M. / Vrang, L. / Edlund, M. / Rosenquist, A. / Samuelsson, B. / Raboisson, P. / Simmen, K. |
External links | Angew. Chem. Int. Ed. Engl. / PubMed:20166108 |
Methods | X-ray diffraction |
Resolution | 2.4 - 2.5 Å |
Structure data | PDB-3kee: PDB-3kf2: |
Chemicals | ChemComp-30B: ChemComp-ZN: ChemComp-GOL: ChemComp-HOH: |
Source |
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Keywords | HYDROLASE / HCV / NS3 / NS4A / macrocycle / noncovalent / TMC435 / Protease / Apo |