The Structure of CK2alpha with CCh507 bound

Summary for 6FVG

DescriptorCasein kinase II subunit alpha, [1-[2-(phenylsulfonylamino)ethyl]piperidin-4-yl]methyl 1~{H}-indole-3-carboxylate, ADENOSINE-5'-TRIPHOSPHATE, ... (4 entities in total)
Functional Keywordsck2alpha, ck2a, fragment based drug discovery, high concentration screening, selective atp competitive inhibitors, surface entrophy reduction, transferase
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total molecular weight39980.12
Primary citation
Prudent, R.,Laudet, B.,Filhol, O.,Cochet, C.,Sautel, C.,Moucadel, V.,Bestgen, B.,Engel, M.,Ettaoussi, M.,Lomberget, T.,Le Borgne, M.,Kufareva, I.,Abagyan, R.,Brear, P.,Hyvonen, M.
Structure-Based Discovery of Small Molecules Targeting the Flexible CK2 Subunit Interface
To Be Published,
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.23110 0.7% 8.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution