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Structure paper

TitleInsight into the Inhibition of Drug-Resistant Mutants of the Receptor Tyrosine Kinase EGFR.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 55, Page 10909-10912, Year 2016
Publish dateApr 11, 2016 (structure data deposition date)
AuthorsEngel, J. / Becker, C. / Lategahn, J. / Keul, M. / Ketzer, J. / Muhlenberg, T. / Kollipara, L. / Schultz-Fademrecht, C. / Zahedi, R.P. / Bauer, S. / Rauh, D.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:27496389
MethodsX-ray diffraction
Resolution2.5 - 2.8 Å
Structure data

PDB-5j9y:
EGFR-T790M in complex with pyrazolopyrimidine inhibitor 1b
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-5j9z:
EGFR-T790M in complex with pyrazolopyrimidine inhibitor 1a
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-6HL:
(R)-1-(3-(4-amino-3-(naphthalen-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one

ChemComp-HOH:
WATER

ChemComp-6HJ:
(R)-1-(3-(4-amino-3-(1-methyl-1H-indol-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl)prop-2-en-1-one

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / tyrosine kinase / covalent inhibitor / drug resistance

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