4JSR

Crystal Structure of human SIRT3 with ELT inhibitor 11c [N-{2-[1-(6-carbamoylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]ethyl}-N'-ethylthiophene-2,5-dicarboxamide]

Summary for 4JSR

• Entry DOI: 10.2210/pdb4jsr/pdb
• Related: 4JT8 4JT9
• Descriptor: NAD-dependent protein deacetylase sirtuin-3, mitochondrial, ZINC ION, N-{2-[1-(6-carbamoylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]ethyl}-N'-ethylthiophene-2,5-dicarboxamide, ... (4 entities in total)
• Functional Keywords: deacetylase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Mitochondrion matrix: Q9NTG7
• Total number of polymer chains: 1
• Total formula weight: 32164.37

Authors

Dai, H. (deposition date: 2013-03-22, release date: 2013-04-24, Last modification date: 2024-02-28)

• Primary citation: Disch, J.S.,Evindar, G.,Chiu, C.H.,Blum, C.A.,Dai, H.,Jin, L.,Schuman, E.,Lind, K.E.,Belyanskaya, S.L.,Deng, J.,Coppo, F.,Aquilani, L.,Graybill, T.L.,Cuozzo, J.W.,Lavu, S.,Mao, C.,Vlasuk, G.P.,Perni, R.B.; Discovery of Thieno[3,2-d]pyrimidine-6-carboxamides as Potent Inhibitors of SIRT1, SIRT2, and SIRT3.; J.Med.Chem., 56:3666-3679, 2013; PubMed: 23570514; DOI: 10.1021/jm400204k

Experimental method

X-RAY DIFFRACTION (1.7 Å)