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Title"Addition" and "Subtraction": Selectivity Design for Type II Maternal Embryonic Leucine Zipper Kinase Inhibitors.
Journal, issue, pagesJ. Med. Chem., Vol. 60, Page 2155-2161, Year 2017
Publish dateMay 17, 2016 (structure data deposition date)
AuthorsChen, X. / Giraldes, J. / Sprague, E.R. / Shakya, S. / Chen, Z. / Wang, Y. / Joud, C. / Mathieu, S. / Chen, C.H. / Straub, C. ...Chen, X. / Giraldes, J. / Sprague, E.R. / Shakya, S. / Chen, Z. / Wang, Y. / Joud, C. / Mathieu, S. / Chen, C.H. / Straub, C. / Duca, J. / Hurov, K. / Yuan, Y. / Shao, W. / Toure, B.B.
External linksJ. Med. Chem. / PubMed:28186750
MethodsX-ray diffraction
Resolution1.77 Å
Structure data

PDB-5k00:
MELK in complex with NVS-MELK5
Method: X-RAY DIFFRACTION / Resolution: 1.77 Å

Chemicals

ChemComp-6PV:
4-{2-[(3-methoxyphenyl)amino]-4-[(piperidin-4-yl)methoxy]pyrimidin-5-yl}-N-[2-oxo-2-(phenylamino)ethyl]benzamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / kinase UBA typeII inhibitor / TRANSFERASE-TRANSFERASE INHIBITOR complex

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