5SZ3

Carbonic anhydrase II in complex with 4-(3-quinolinyl)-benzenesulfonamide

Summary for 5SZ3

Related5SZ0 5SZ1 5SZ2 5SZ4 5SZ5 5SZ6 5SZ7
DescriptorCarbonic anhydrase 2, ZINC ION, DIMETHYL SULFOXIDE, ... (5 entities in total)
Functional Keywordssulfonamide, inhibitor, zinc-binding, lyase-lyase inhibitor complex, lyase/lyase inhibitor
Biological sourceHomo sapiens (Human)
Cellular locationCytoplasm  P00918
Total number of polymer chains1
Total molecular weight29673.05
Authors
Bhatt, A.,Mahon, B.P.,Cornelio, B.,McKenna, R. (deposition date: 2016-08-12, release date: 2016-12-21, Last modification date: 2017-02-01)
Primary citation
Bhatt, A.,Mahon, B.P.,Cruzeiro, V.W.,Cornelio, B.,Laronze-Cochard, M.,Ceruso, M.,Sapi, J.,Rance, G.A.,Khlobystov, A.N.,Fontana, A.,Roitberg, A.,Supuran, C.T.,McKenna, R.
Structure-Activity Relationships of Benzenesulfonamide-Based Inhibitors towards Carbonic Anhydrase Isoform Specificity.
Chembiochem, 18:213-222, 2017
PubMed: 27860128 (PDB entries with the same primary citation)
DOI: 10.1002/cbic.201600513
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.689 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.203700.5%1.9%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution