2O5K

Crystal Structure of GSK3beta in complex with a benzoimidazol inhibitor

Summary for 2O5K

DescriptorGlycogen synthase kinase-3 beta, 2-(2,4-DICHLORO-PHENYL)-7-HYDROXY-1H-BENZOIMIDAZOLE-4-CARBOXYLIC ACID [2-(4-METHANESULFONYLAMINO-PHENYL)-ETHYL]-AMIDE (2 entities in total)
Functional Keywordsgsk3beta, benzoimidazol inhibitor, transferase
Biological sourceHomo sapiens (human)
Cellular locationCytoplasm P49841
Total number of polymer chains1
Total molecular weight42784.81
Authors
Shin, D.,Lee, S.C.,Heo, Y.S.,Cho, Y.S.,Kim, Y.E.,Hyun, Y.L.,Cho, J.M.,Lee, Y.S.,Ro, S. (deposition date: 2006-12-06, release date: 2007-10-23, Last modification date: 2011-07-13)
Primary citation
Shin, D.,Lee, S.C.,Heo, Y.S.,Lee, W.Y.,Cho, Y.S.,Kim, Y.E.,Hyun, Y.L.,Cho, J.M.,Lee, Y.S.,Ro, S.
Design and synthesis of 7-hydroxy-1H-benzoimidazole derivatives as novel inhibitors of glycogen synthase kinase-3beta
Bioorg.Med.Chem.Lett., 17:5686-5689, 2007
PubMed: 17764934 (PDB entries with the same primary citation)
DOI: 10.1016/j.bmcl.2007.07.056
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (3.2 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.308388.6%8.1%8.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution

More Asymmetric unit images

Molmil generated image of 2o5k
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Molmil generated image of 2o5k
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Molmil generated image of 2o5k
rotated about y axis by 90°