6GN1

Crystal Structure of Glycogen synthase kinase-3 beta (GSK3B) in Complex with PIK-75

Summary for 6GN1

Entry DOI	10.2210/pdb6gn1/pdb
Descriptor	Glycogen synthase kinase-3 beta, CHLORIDE ION, ~{N}-[(~{E})-(6-bromanylimidazo[1,2-a]pyridin-3-yl)methylideneamino]-~{N},2-dimethyl-5-nitro-benzenesulfonamide, ... (4 entities in total)
Functional Keywords	glycogen synthase kinase-3 beta, pik-75, halogen bond, inhibitor, transferase
Biological source	Homo sapiens (Human)
Total number of polymer chains	2
Total formula weight	84316.83
Authors	Tesch, R.,Becker, C.,Mueller, M.P.,Sant'Anna, C.M.R.,Fraga, C.A.M.,Rauh, D. (deposition date: 2018-05-29, release date: 2018-06-20, Last modification date: 2024-01-17)
Primary citation	Tesch, R.,Becker, C.,Muller, M.P.,Beck, M.E.,Quambusch, L.,Getlik, M.,Lategahn, J.,Uhlenbrock, N.,Costa, F.N.,Poleto, M.D.,Pinheiro, P.S.M.,Rodrigues, D.A.,Sant'Anna, C.M.R.,Ferreira, F.F.,Verli, H.,Fraga, C.A.M.,Rauh, D. An Unusual Intramolecular Halogen Bond Guides Conformational Selection. Angew. Chem. Int. Ed. Engl., 57:9970-9975, 2018 Cited by PubMed: 29873877 DOI: 10.1002/anie.201804917 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.6 Å)

Structure validation