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TitleDiscovery of STX-721, a Covalent, Potent, and Highly Mutant-Selective EGFR/HER2 Exon20 Insertion Inhibitor for the Treatment of Non-Small Cell Lung Cancer.
Journal, issue, pagesJ. Med. Chem., Vol. 68, Page 2403-2421, Year 2025
Publish dateJun 17, 2024 (structure data deposition date)
AuthorsMilgram, B.C. / Borrelli, D.R. / Brooijmans, N. / Henderson, J.A. / Hilbert, B.J. / Huff, M.R. / Ito, T. / Jackson, E.L. / Jonsson, P. / Ladd, B. ...Milgram, B.C. / Borrelli, D.R. / Brooijmans, N. / Henderson, J.A. / Hilbert, B.J. / Huff, M.R. / Ito, T. / Jackson, E.L. / Jonsson, P. / Ladd, B. / O'Hearn, E.L. / Pagliarini, R.A. / Roberts, S.A. / Ronseaux, S. / Stuart, D.D. / Wang, W. / Guzman-Perez, A.
External linksJ. Med. Chem. / PubMed:39824516
MethodsX-ray diffraction
Resolution1.783 - 2.495 Å
Structure data

PDB-9fqp:
EGFR Exon20 insertion mutant NPG bound with Compound 23
Method: X-RAY DIFFRACTION / Resolution: 2.495 Å

PDB-9fqs:
EGFR Exon20 insertion mutant NPG bound with Compound 39
Method: X-RAY DIFFRACTION / Resolution: 1.783 Å

PDB-9frd:
Wildtype EGFR bound with Compound 23
Method: X-RAY DIFFRACTION / Resolution: 2.06 Å

Chemicals

PDB-1iez:
Solution Structure of 3,4-Dihydroxy-2-Butanone 4-Phosphate Synthase of Riboflavin Biosynthesis

ChemComp-HOH:
WATER

ChemComp-EDO:
1,2-ETHANEDIOL

PDB-1ie0:
CRYSTAL STRUCTURE OF LUXS

ChemComp-DTT:
2,3-DIHYDROXY-1,4-DITHIOBUTANE

ChemComp-CL:
Unknown entry

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / Kinase / inhibitor / ONCOPROTEIN / EGFR wildtype

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