8PQC

c-KIT kinase domain in complex with avapritinib derivative 9

Summary for 8PQC

• Entry DOI: 10.2210/pdb8pqc/pdb
• Descriptor: Mast/stem cell growth factor receptor Kit, (1~{S})-~{N}-ethyl-1-(4-fluorophenyl)-1-[2-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethanamine (3 entities in total)
• Functional Keywords: c-kit, protein kinase, avapritinib, inhibitor, tyrosine kinase, transmembrane receptor, stem cell factor, stem cell factor receptor, gist, gastrointestinal stromal tumors, p10721, transferase
• Biological source: Homo sapiens (human); More
• Total number of polymer chains: 2
• Total formula weight: 75442.08

Authors

Teuber, A.,Kleinboelting, S.B.,Mueller, M.P.,Rauh, D. (deposition date: 2023-07-11, release date: 2023-12-27, Last modification date: 2024-03-13)

• Primary citation: Teuber, A.,Schulz, T.,Fletcher, B.S.,Gontla, R.,Muhlenberg, T.,Zischinsky, M.L.,Niggenaber, J.,Weisner, J.,Kleinbolting, S.B.,Lategahn, J.,Sievers, S.,Muller, M.P.,Bauer, S.,Rauh, D.; Avapritinib-based SAR studies unveil a binding pocket in KIT and PDGFRA.; Nat Commun, 15:63-63, 2024; PubMed: 38167404; DOI: 10.1038/s41467-023-44376-8

Experimental method

X-RAY DIFFRACTION (1.77 Å)