8DJC
CRYSTAL STRUCTURE OF GLYCOGEN SYNTHASE KINASE 3 BETA COMPLEXED WITH (4S)-N-{4-[(2S)-2-methylmorpholin-4-yl] pyridin-3-yl}-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide
Summary for 8DJC
Entry DOI | 10.2210/pdb8djc/pdb |
Descriptor | Glycogen synthase kinase-3 beta, (4S)-N-{4-[(2S)-2-methylmorpholin-4-yl]pyridin-3-yl}-2-phenylimidazo[1,2-b]pyridazine-8-carboxamide (3 entities in total) |
Functional Keywords | kinase, gsk3b, transferase-transferase inhibitor complex, transferase, transferase-inhibitor complex, transferase/inhibitor |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 2 |
Total formula weight | 99418.58 |
Authors | Lewis, H.A.,Muckelbauer, J.K. (deposition date: 2022-06-30, release date: 2023-03-22, Last modification date: 2024-04-03) |
Primary citation | Hartz, R.A.,Ahuja, V.T.,Sivaprakasam, P.,Xiao, H.,Krause, C.M.,Clarke, W.J.,Kish, K.,Lewis, H.,Szapiel, N.,Ravirala, R.,Mutalik, S.,Nakmode, D.,Shah, D.,Burton, C.R.,Macor, J.E.,Dubowchik, G.M. Design, Structure-Activity Relationships, and In Vivo Evaluation of Potent and Brain-Penetrant Imidazo[1,2- b ]pyridazines as Glycogen Synthase Kinase-3 beta (GSK-3 beta ) Inhibitors. J.Med.Chem., 66:4231-4252, 2023 Cited by PubMed: 36950863DOI: 10.1021/acs.jmedchem.3c00133 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.463 Å) |
Structure validation
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