9BJ1

Crystal structure of inhibitor GNE-6893 bound to HPK1

This is a non-PDB format compatible entry.

Summary for 9BJ1

• Entry DOI: 10.2210/pdb9bj1/pdb
• Descriptor: Mitogen-activated protein kinase kinase kinase kinase 1, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 1,2-ETHANEDIOL, ... (9 entities in total)
• Functional Keywords: hpk1, map4k1, cancer, pharmacology, kinase, inhibitor, signaling protein
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 72176.37

Authors

Kiefer, J.R.,Tellis, J.C.,Chan, B.K.,Wang, W.,Wu, P.,Choo, E.F.,Heffron, T.P.,Wei, B.,Siu, M. (deposition date: 2024-04-24, release date: 2024-10-02)

• Primary citation: Tellis, J.C.,Wei, B.,Siu, M.,An, L.,Chan, G.K.,Chen, Y.,Du, X.,Gazzard, L.,Hu, B.,Kiefer, J.,Kakiuchi-Kiyota, S.,Lainchbury, M.,Linehan, J.L.,Luo, X.,Malhotra, S.,Mendonca, R.,Pang, J.,Ran, Y.,Sethuraman, V.,Seward, E.,Sneeringer, C.,Su, D.,Wang, W.,Wu, P.,Moffat, J.G.,Heffron, T.P.,Choo, E.F.,Chan, B.K.; Discovery of GNE-6893, a Potent, Selective, Orally Bioavailable Small Molecule Inhibitor of HPK1.; Acs Med.Chem.Lett., 15:1606-1614, 2024; PubMed: 39291002; DOI: 10.1021/acsmedchemlett.4c00319

Experimental method

X-RAY DIFFRACTION (2.18 Å)