3BHY

Crystal structure of human death associated protein kinase 3 (DAPK3) in complex with a beta-carboline ligand

Summary for 3BHY

• Entry DOI: 10.2210/pdb3bhy/pdb
• Descriptor: Death-associated protein kinase 3, CHLORIDE ION, (4R)-7,8-dichloro-1',9-dimethyl-1-oxo-1,2,4,9-tetrahydrospiro[beta-carboline-3,4'-piperidine]-4-carbonitrile, ... (4 entities in total)
• Functional Keywords: death associated kinase, dapk3, zip kinase, zipk, dap kinase 3, dap like kinase, dlk, structural genomics consortium, sgc, apoptosis, atp-binding, chromatin regulator, nucleotide-binding, nucleus, serine/threonine-protein kinase, transferase
• Biological source: Homo sapiens (human)
• Cellular location: Nucleus . Isoform 1: Nucleus . Isoform 2: Nucleus : O43293
• Total number of polymer chains: 1
• Total formula weight: 32957.84

Authors

Filippakopoulos, P.,Rellos, P.,Eswaran, J.,Fedorov, O.,Berridge, G.,Niesen, F.,Bracher, F.,Huber, K.,Pike, A.C.W.,Roos, A.,von Delft, F.,Arrowsmith, C.H.,Edwards, A.M.,Weigelt, J.,Knapp, S.,Structural Genomics Consortium (SGC) (deposition date: 2007-11-29, release date: 2007-12-25, Last modification date: 2023-08-30)

• Primary citation: Huber, K.,Brault, L.,Fedorov, O.,Gasser, C.,Filippakopoulos, P.,Bullock, A.N.,Fabbro, D.,Trappe, J.,Schwaller, J.,Knapp, S.,Bracher, F.; 7,8-dichloro-1-oxo-beta-carbolines as a versatile scaffold for the development of potent and selective kinase inhibitors with unusual binding modes.; J.Med.Chem., 55:403-413, 2012; PubMed: 22136433; DOI: 10.1021/jm201286z

Experimental method

X-RAY DIFFRACTION (1.24 Å)