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-Structure paper
Title | Novel Oxindole Sulfonamides and Sulfamides: EPZ031686, the First Orally Bioavailable Small Molecule SMYD3 Inhibitor. |
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Journal, issue, pages | Acs Med. Chem. Lett., Vol. 7, Page 134-138, Year 2016 |
Publish date | Jul 2, 2015 (structure data deposition date) |
Authors | Mitchell, L.H. / Boriack-Sjodin, P.A. / Smith, S. / Thomenius, M. / Rioux, N. / Munchhof, M. / Mills, J.E. / Klaus, C. / Totman, J. / Riera, T.V. ...Mitchell, L.H. / Boriack-Sjodin, P.A. / Smith, S. / Thomenius, M. / Rioux, N. / Munchhof, M. / Mills, J.E. / Klaus, C. / Totman, J. / Riera, T.V. / Raimondi, A. / Jacques, S.L. / West, K. / Foley, M. / Waters, N.J. / Kuntz, K.W. / Wigle, T.J. / Scott, M.P. / Copeland, R.A. / Smith, J.J. / Chesworth, R. |
External links | Acs Med. Chem. Lett. / PubMed:26985287 |
Methods | X-ray diffraction |
Resolution | 1.5 - 2.3 Å |
Structure data | PDB-5ccl: PDB-5ccm: |
Chemicals | ChemComp-ZN: ChemComp-SAM: ChemComp-4ZW: ChemComp-EDO: ChemComp-HOH: ChemComp-4ZX: |
Source |
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Keywords | TRANSFERASE/TRANSFERASE Inhibitor / Protein-inhibitor complex / methyltransferase / epigenetics / drug discovery / TRANSFERASE-TRANSFERASE Inhibitor complex |