3DU8

Crystal structure of GSK-3 beta in complex with NMS-869553A

Summary for 3DU8

• Entry DOI: 10.2210/pdb3du8/pdb
• Descriptor: Glycogen synthase kinase-3 beta, (7S)-2-(2-aminopyrimidin-4-yl)-7-(2-fluoroethyl)-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one (3 entities in total)
• Functional Keywords: protein kinase, alternative splicing, atp-binding, nucleotide-binding, phosphoprotein, serine/threonine-protein kinase, transferase
• Biological source: Homo sapiens
• Cellular location: Cytoplasm : P49841
• Total number of polymer chains: 2
• Total formula weight: 94461.33

Authors

Bossi, R.T. (deposition date: 2008-07-17, release date: 2009-03-03, Last modification date: 2023-08-30)

• Primary citation: Menichincheri, M.,Bargiotti, A.,Berthelsen, J.,Bertrand, J.A.,Bossi, R.,Ciavolella, A.,Cirla, A.,Cristiani, C.,Croci, V.,D'Alessio, R.,Fasolini, M.,Fiorentini, F.,Forte, B.,Isacchi, A.,Martina, K.,Molinari, A.,Montagnoli, A.,Orsini, P.,Orzi, F.,Pesenti, E.,Pezzetta, D.,Pillan, A.,Poggesi, I.,Roletto, F.,Scolaro, A.,Tato, M.,Tibolla, M.,Valsasina, B.,Varasi, M.,Volpi, D.,Santocanale, C.,Vanotti, E.; First Cdc7 kinase inhibitors: pyrrolopyridinones as potent and orally active antitumor agents. 2. Lead discovery.; J.Med.Chem., 52:293-307, 2009; PubMed: 19115845; DOI: 10.1021/jm800977q

Experimental method

X-RAY DIFFRACTION (2.2 Å)