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Structure paper

TitleStructural insights into the potency and selectivity of covalent pan-FGFR inhibitors
Journal, issue, pagesCommun Chem, Vol. 5, Page 5-, Year 2022
Publish dateSep 25, 2020 (structure data deposition date)
AuthorsQu, L. / Chen, X. / Wei, H. / Guo, M. / Dai, S. / Jiang, L. / Li, J. / Yue, S. / Chen, Z. / Chen, Y.
External linksCommun Chem / Search PubMed
MethodsX-ray diffraction
Resolution2.104 - 2.69 Å
Structure data

PDB-7d57:
C-Src in complex with FIIN-2
Method: X-RAY DIFFRACTION / Resolution: 2.104 Å

PDB-7d5o:
C-Src in complex with TAS-120
Method: X-RAY DIFFRACTION / Resolution: 2.69 Å

PDB-7f3m:
Crystal structure of FGFR4 kinase domain with PRN1371
Method: X-RAY DIFFRACTION / Resolution: 2.289 Å

Chemicals

ChemComp-37O:
N-(4-{[3-(3,5-dimethoxyphenyl)-7-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-oxo-3,4-dihydropyrimido[4,5-d]pyrimidin-1(2H)-yl]methyl}phenyl)propanamide

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-TZ0:
1-[(3S)-3-{4-amino-3-[(3,5-dimethoxyphenyl)ethynyl]-1H-pyrazolo[3,4-d]pyrimidin-1-yl}pyrrolidin-1-yl]prop-2-en-1-one

ChemComp-GX3:
6-[2,6-bis(chloranyl)-3,5-dimethoxy-phenyl]-2-(methylamino)-8-[3-(4-prop-2-enoylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidin-7-one

Source
  • gallus gallus (chicken)
  • homo sapiens (human)
KeywordsTRANSFERASE / TRANSFERASE INHIBITOR / TRANSFERASE-TRANSFERASE INHIBITOR / Kinase / Inhibitor / Complex / STRUCTURAL PROTEIN / TRANSFERASE-TRANSFERASE INHIBITOR complex

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