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TitleInvestigation of Covalent Warheads in the Design of 2-Aminopyrimidine-based FGFR4 Inhibitors.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 12, Page 647-652, Year 2021
Publish dateJan 7, 2021 (structure data deposition date)
AuthorsDeng, W. / Chen, X. / Jiang, K. / Song, X. / Huang, M. / Tu, Z.C. / Zhang, Z. / Lin, X. / Ortega, R. / Patterson, A.V. ...Deng, W. / Chen, X. / Jiang, K. / Song, X. / Huang, M. / Tu, Z.C. / Zhang, Z. / Lin, X. / Ortega, R. / Patterson, A.V. / Smaill, J.B. / Ding, K. / Chen, S. / Chen, Y. / Lu, X.
External linksAcs Med. Chem. Lett. / PubMed:33859803
MethodsX-ray diffraction
Resolution2.01 Å
Structure data

PDB-7dtz:
FGFR4 complex with a covalent inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.01 Å

Chemicals

ChemComp-HHL:
N-[2-[[5-[[2,6-bis(chloranyl)-3,5-dimethoxy-phenyl]methoxy]pyrimidin-2-yl]amino]-3-methyl-phenyl]-2-fluoranyl-prop-2-enamide

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Inhibitor / Covalent / Crystal

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