2C1B

Structure of cAMP-dependent protein kinase complexed with (4R,2S)-5'-(4-(4-Chlorobenzyloxy)pyrrolidin-2-ylmethanesulfonyl)isoquinoline

Summary for 2C1B

• Entry DOI: 10.2210/pdb2c1b/pdb
• Related: 1CMK 1KMU 1KMW 1Q24 1Q61 1Q62 1Q8T 1Q8U 1Q8W 1SMH 1STC 1SVE 1SVG 1SVH 1SZM 1VEB 1YDR 1YDS 1YDT 2C1A
• Descriptor: CAMP-DEPENDENT PROTEIN KINASE, CAMP-DEPENDENT PROTEIN KINASE INHIBITOR, (4R,2S)-5'-(4-(4-CHLOROBENZYLOXY)PYRROLIDIN-2-YLMETHANESULFONYL)ISOQUINOLINE, ... (4 entities in total)
• Functional Keywords: transferase/inhibitor, complex (transferase-inhibitor), atp-binding, camp, phosphorylation, transferase, serine/threonine-protein kinase, protein kinase inhibitor, transferase-inhibitor complex
• Biological source: BOS TAURUS; More
• Cellular location: Cytoplasm : P00517
• Total number of polymer chains: 2
• Total formula weight: 43495.96

Authors

Collins, I.,Caldwell, J.,Fonseca, T.,Donald, A.,Bavetsias, V.,Hunter, L.J.,Garrett, M.D.,Rowlands, M.G.,Aherne, G.W.,Davies, T.G.,Berdini, V.,Woodhead, S.J.,Seavers, L.C.A.,Wyatt, P.G.,Workman, P.,McDonald, E. (deposition date: 2005-09-12, release date: 2005-11-02, Last modification date: 2018-02-28)

• Primary citation: Collins, I.,Caldwell, J.,Fonseca, T.,Donald, A.,Bavetsias, V.,Hunter, L.J.,Garrett, M.D.,Rowlands, M.G.,Aherne, G.W.,Davies, T.G.,Berdini, V.,Woodhead, S.J.,Davis, D.,Seavers, L.C.,Wyatt, P.G.,Workman, P.,McDonald, E.; Structure-based design of isoquinoline-5-sulfonamide inhibitors of protein kinase B.; Bioorg. Med. Chem., 14:1255-1273, 2006; PubMed: 16249095; DOI: 10.1016/j.bmc.2005.09.055

Experimental method

X-RAY DIFFRACTION (2 Å)