3FC1

Crystal structure of p38 kinase bound to pyrimido-pyridazinone inhibitor

Summary for 3FC1

Entry DOI	10.2210/pdb3fc1/pdb
Descriptor	Mitogen-activated protein kinase 14, CHLORIDE ION, 5-(2,6-dichlorophenyl)-2-[(2,4-difluorophenyl)sulfanyl]-6H-pyrimido[1,6-b]pyridazin-6-one, ... (4 entities in total)
Functional Keywords	kinase inhibitor, atp-binding, nucleotide-binding, nucleus, phosphoprotein, serine/threonine-protein kinase, transferase
Biological source	Homo sapiens
Cellular location	Cytoplasm (By similarity): Q16539
Total number of polymer chains	1
Total formula weight	42470.65
Authors	Jacobs, M.D.,Bellon, S. (deposition date: 2008-11-20, release date: 2008-12-09, Last modification date: 2023-12-27)
Primary citation	Pearlman, D.A. Evaluating the molecular mechanics poisson-boltzmann surface area free energy method using a congeneric series of ligands to p38 MAP kinase. J.Med.Chem., 48:7796-7807, 2005 Cited by PubMed: 16302819 DOI: 10.1021/jm050306m PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.4 Å)

Structure validation