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-Structure paper
Title | From a novel HTS hit to potent, selective, and orally bioavailable KDM5 inhibitors. |
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Journal, issue, pages | Bioorg. Med. Chem. Lett., Vol. 27, Page 2974-2981, Year 2017 |
Publish date | Mar 23, 2017 (structure data deposition date) |
![]() | Liang, J. / Labadie, S. / Zhang, B. / Ortwine, D.F. / Patel, S. / Vinogradova, M. / Kiefer, J.R. / Mauer, T. / Gehling, V.S. / Harmange, J.C. ...Liang, J. / Labadie, S. / Zhang, B. / Ortwine, D.F. / Patel, S. / Vinogradova, M. / Kiefer, J.R. / Mauer, T. / Gehling, V.S. / Harmange, J.C. / Cummings, R. / Lai, T. / Liao, J. / Zheng, X. / Liu, Y. / Gustafson, A. / Van der Porten, E. / Mao, W. / Liederer, B.M. / Deshmukh, G. / An, L. / Ran, Y. / Classon, M. / Trojer, P. / Dragovich, P.S. / Murray, L. |
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Methods | X-ray diffraction |
Resolution | 3 - 3.05 Å |
Structure data | ![]() PDB-5v9p: ![]() PDB-5v9t: |
Chemicals | ![]() ChemComp-NI: ![]() ChemComp-ZN: ![]() ChemComp-90S: ![]() ChemComp-SO4: ![]() ChemComp-HOH: ![]() ChemComp-90V: |
Source |
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![]() | OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / epigenetics / histone demethylase / cancer / inhibitor / selective / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex / KDM5 / KDM5a |