7O7J

Crystal structure of the human HIPK3 kinase domain bound to abemaciclib

Summary for 7O7J

Entry DOI	10.2210/pdb7o7j/pdb
Descriptor	Homeodomain-interacting protein kinase 3, N-{5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl}-5-fluoro-4-[4-fluoro-2-methyl-1-(propan-2-yl)-1H-benzimidazol-6-yl]py rimidin-2-amine (3 entities in total)
Functional Keywords	serine/threonine kinase, cmgc kinase, homeodomain-interacting protein kinase 3, transcription, abemaciclib, transferase
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	46651.43
Authors	Kaltheuner, I.H.,Anand, K.,Geyer, M. (deposition date: 2021-04-13, release date: 2021-11-24, Last modification date: 2021-12-01)
Primary citation	Kaltheuner, I.H.,Anand, K.,Moecking, J.,Duster, R.,Wang, J.,Gray, N.S.,Geyer, M. Abemaciclib is a potent inhibitor of DYRK1A and HIP kinases involved in transcriptional regulation. Nat Commun, 12:6607-6607, 2021 Cited by PubMed: 34785661 DOI: 10.1038/s41467-021-26935-z PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.81 Å)

Structure validation