8CDW

CRYSTAL STRUCTURE OF HUMAN HPK1 (MAP4K1) COMPLEX WITH 7-(1-methyl-1H-pyrazol-4-yl)-N-[4-(1-methylpiperidin-4-yl)phenyl]quinazolin-2-amine

Summary for 8CDW

• Entry DOI: 10.2210/pdb8cdw/pdb
• Descriptor: Mitogen-activated protein kinase kinase kinase kinase 1, ~{N}-[4-(1-methylpiperidin-4-yl)phenyl]-7-(1-methylpyrazol-4-yl)quinazolin-2-amine (3 entities in total)
• Functional Keywords: protein kinase, signaling protein, transferase, map4k1, hematopoietic progenitor kinase
• Biological source: Homo sapiens (human)
• Total number of polymer chains: 2
• Total formula weight: 69518.51

Authors

Musil, D.,Toure, M. (deposition date: 2023-02-01, release date: 2023-08-16)

• Primary citation: Toure, M.,Johnson, T.,Li, B.,Schmidt, R.,Ma, H.,Neagu, C.,Lopez, A.U.,Wang, Y.,Guler, S.,Xiao, Y.,Henkes, R.,Ho, K.,Zhang, S.,Chu, C.L.,Gundra, U.M.,Porichis, F.,Li, L.,Maurer, C.K.,Fang, Z.,Musil, D.,DiPoto, M.,Friis, E.,Jones, R.,Jones, C.,Cummings, J.,Chekler, E.,Tanzer, E.M.,Huck, B.,Sherer, B.; Discovery of quinazoline HPK1 inhibitors with high cellular potency.; Bioorg.Med.Chem., 92:117423-117423, 2023; PubMed: 37531921; DOI: 10.1016/j.bmc.2023.117423

Experimental method

X-RAY DIFFRACTION (1.941 Å)