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TitleStructure-Based Discovery of M-89 as a Highly Potent Inhibitor of the Menin-Mixed Lineage Leukemia (Menin-MLL) Protein-Protein Interaction.
Journal, issue, pagesJ. Med. Chem., Vol. 62, Page 6015-6034, Year 2019
Publish dateJul 9, 2018 (structure data deposition date)
AuthorsAguilar, A. / Zheng, K. / Xu, T. / Xu, S. / Huang, L. / Fernandez-Salas, E. / Liu, L. / Bernard, D. / Harvey, K.P. / Foster, C. ...Aguilar, A. / Zheng, K. / Xu, T. / Xu, S. / Huang, L. / Fernandez-Salas, E. / Liu, L. / Bernard, D. / Harvey, K.P. / Foster, C. / McEachern, D. / Stuckey, J. / Chinnaswamy, K. / Delproposto, J. / Kampf, J.W. / Wang, S.
External linksJ. Med. Chem. / PubMed:31244110
MethodsX-ray diffraction
Resolution3.1 Å
Structure data

PDB-6e1a:
Menin bound to M-89
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

Chemicals

ChemComp-HL7:
(1S,2R)-2-[(4S)-2-methyl-4-{1-[(1-{4-[(pyridin-4-yl)sulfonyl]phenyl}azetidin-3-yl)methyl]piperidin-4-yl}-1,2,3,4-tetrahydroisoquinolin-4-yl]cyclopentyl methylcarbamate

ChemComp-7PR:
praseodymium triacetate

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsPROTEIN BINDING / inhibitor / transcription

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