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Structure paper

TitleAn allosteric inhibitor against the therapy-resistant mutant forms of EGFR in non-small cell lung cancer.
Journal, issue, pagesNat Cancer, Vol. 3, Page 402-417, Year 2022
Publish dateAug 27, 2020 (structure data deposition date)
AuthorsTo, C. / Beyett, T.S. / Jang, J. / Feng, W.W. / Bahcall, M. / Haikala, H.M. / Shin, B.H. / Heppner, D.E. / Rana, J.K. / Leeper, B.A. ...To, C. / Beyett, T.S. / Jang, J. / Feng, W.W. / Bahcall, M. / Haikala, H.M. / Shin, B.H. / Heppner, D.E. / Rana, J.K. / Leeper, B.A. / Soroko, K.M. / Poitras, M.J. / Gokhale, P.C. / Kobayashi, Y. / Wahid, K. / Kurppa, K.J. / Gero, T.W. / Cameron, M.D. / Ogino, A. / Mushajiang, M. / Xu, C. / Zhang, Y. / Scott, D.A. / Eck, M.J. / Gray, N.S. / Janne, P.A.
External linksNat Cancer / PubMed:35422503
MethodsX-ray diffraction
Resolution1.83 Å
Structure data

PDB-7jxq:
EGFR kinase (T790M/V948R) in complex with allosteric inhibitor JBJ-09-063
Method: X-RAY DIFFRACTION / Resolution: 1.83 Å

Chemicals

ChemComp-MG:
Unknown entry

ChemComp-ANP:
PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER / AMP-PNP, energy-carrying molecule analogue*YM

ChemComp-VNS:
(2R)-2-(5-fluoro-2-hydroxyphenyl)-2-{6-[4-(1-methylpiperidin-4-yl)phenyl]-1-oxo-1,3-dihydro-2H-isoindol-2-yl}-N-(1,3-thiazol-2-yl)acetamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE Inhibitor / EGFR / ErbB1 / kinase / inhibitor / TRANSFERASE / TRANSFERASE-TRANSFERASE Inhibitor complex

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