5CS6

Crystal Structure of CK2alpha with Compound 3 bound

Summary for 5CS6

Entry DOI	10.2210/pdb5cs6/pdb
Descriptor	Casein kinase II subunit alpha, ACETATE ION, 1-(3-chloro-4-propoxyphenyl)methanamine, ... (5 entities in total)
Functional Keywords	transferase, ck2alpha, ck2a, fragment based drug discovery, high concentration screening, selective atp competitive inhibitors, surface entrophy reduction
Biological source	Homo sapiens (Human)
Cellular location	Nucleus : P68400
Total number of polymer chains	2
Total formula weight	84065.44
Authors	Brear, P.,De Fusco, C.,Georgiou, K.H.,Spring, D.,Hyvonen, M. (deposition date: 2015-07-23, release date: 2016-07-27, Last modification date: 2024-01-10)
Primary citation	Brear, P.,De Fusco, C.,Hadje Georgiou, K.,Francis-Newton, N.J.,Stubbs, C.J.,Sore, H.F.,Venkitaraman, A.R.,Abell, C.,Spring, D.R.,Hyvonen, M. Specific inhibition of CK2 alpha from an anchor outside the active site. Chem Sci, 7:6839-6845, 2016 Cited by PubMed: 28451126 DOI: 10.1039/c6sc02335e PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.88 Å)

Structure validation