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Structure paper

TitleStructural Analysis of the Macrocyclic Inhibitor BI-4020 Binding to EGFR Kinase.
Journal, issue, pagesChemmedchem, Page e202300343-e202300343, Year 2024
Publish dateDec 6, 2020 (structure data deposition date)
AuthorsBeyett, T.S. / Rana, J.K. / Schaeffner, I.K. / Heppner, D.E. / Eck, M.J.
External linksChemmedchem / PubMed:38523074
MethodsX-ray diffraction
Resolution2.4 - 3.1 Å
Structure data

PDB-7kxz:
Active conformation of EGFR kinase in complex with BI-4020
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-7ky0:
Inactive conformation of EGFR (T790M/V948R) kinase in complex with BI-4020
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

Chemicals

ChemComp-CL:
Unknown entry

ChemComp-XA4:
(20R)-10,15,20-trimethyl-2-[(4-methylpiperazin-1-yl)methyl]-18,19,20,21-tetrahydro-15H,17H-12,8-(metheno)pyrazolo[3',4':2,3][1,5,10,12]oxatriazacycloheptadecino[12,11-a]benzimidazol-7(6H)-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / EGFR / kinase / inhibitor / macrocycle / TRANSFERASE / TRANSFERASE-TRANSFERASE INHIBITOR complex

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