4RVK

CHK1 kinase domain with diazacarbazole compound 8: N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide

Summary for 4RVK

• Entry DOI: 10.2210/pdb4rvk/pdb
• Related: 4RVL
• Descriptor: Serine/threonine-protein kinase Chk1, N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide (3 entities in total)
• Functional Keywords: protein kinase, phosphotransfer catalyst, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Nucleus: O14757
• Total number of polymer chains: 1
• Total formula weight: 34532.54

Authors

Wiesmann, C.,Wu, P. (deposition date: 2014-11-26, release date: 2015-06-03, Last modification date: 2023-09-20)

• Primary citation: Gazzard, L.,Williams, K.,Chen, H.,Axford, L.,Blackwood, E.,Burton, B.,Chapman, K.,Crackett, P.,Drobnick, J.,Ellwood, C.,Epler, J.,Flagella, M.,Gancia, E.,Gill, M.,Goodacre, S.,Halladay, J.,Hewitt, J.,Hunt, H.,Kintz, S.,Lyssikatos, J.,Macleod, C.,Major, S.,Medard, G.,Narukulla, R.,Ramiscal, J.,Schmidt, S.,Seward, E.,Wiesmann, C.,Wu, P.,Yee, S.,Yen, I.,Malek, S.; Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1.; J.Med.Chem., 58:5053-5074, 2015; PubMed: 25988399; DOI: 10.1021/acs.jmedchem.5b00464

Experimental method

X-RAY DIFFRACTION (1.85 Å)