2VEW

CRYSTAL STRUCUTRE OF PROTEIN TYROSINE PHOSPHATASE 1B IN COMPLEX WITH AN ISOTHIAZOLIDINONE-CONTAINING INHIBITOR

Summary for 2VEW

Related2F6T 2F6F 2CNF 2CM3 2CM2 1G1F 1Q6N 1PTU 1C84 2VEU 1Q1M 1NZ7 2AZR 1C88 1OET 1C83 1SUG 1ONZ 2CNH 1XBO 1PTV 1G1G 2HNP 1T49 1NWL 2F6Y 2CNE 1NL9 1C86 1KAV 2HNQ 1JF7 1PXH 1Q6S 1L8G 2CMA 1Q6M 1BZJ 1I57 1WAX 1ONY 1G1H 2CNG 1T4J 1KAK 2CNI 2B07 2CM8 1EEO 1G7G 1PTT 1QXK 1ECV 1OEM 2CMB 1NWE 2FJN 1AAX 2VEV 2VEY 2B4S 2CM7 2BGD 2VEX 1A5Y 2CMC 1C85 1LQF 2F6W 1C87 1NO6 1PYN 2BGE 1OES 1BZC 2F6Z 2F71 1OEU 1Q6T 1G7F 1NNY 2F70 1Q6J 1Q6P 2F6V 1T48 2FJM 1OEO 1PA1 1PH0 1BZH 1GFY 1EEN 1OEV 1PTY
DescriptorTYROSINE-PROTEIN PHOSPHATASE NON-RECEPTOR TYPE 1, 3-fluoro-N-[(1S)-1-[4-[(2-fluorophenyl)methyl]imidazol-2-yl]-2-[4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]benzenesulfonamide, MAGNESIUM ION, ... (4 entities in total)
Functional Keywordsmembrane, oxidation, hydrolase, acetylation, phosphatase, polymorphism, phosphorylation, protein phosphatase, endoplasmic reticulum
Biological sourceHOMO SAPIENS (HUMAN)
Cellular locationEndoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side  P18031
Total number of polymer chains1
Total molecular weight37974.56
Authors
Douty, B.,Wayland, B.,Ala, P.J.,Bower, M.J.,Pruitt, J.,Bostrom, L.,Wei, M.,Klabe, R.,Gonneville, L.,Wynn, R.,Burn, T.C.,Liu, P.C.C.,Combs, A.P.,Yue, E.W. (deposition date: 2007-10-27, release date: 2007-11-06, Last modification date: 2017-07-05)
Primary citation
Douty, B.,Wayland, B.,Ala, P.J.,Bower, M.J.,Pruitt, J.,Bostrom, L.,Wei, M.,Klabe, R.,Gonneville, L.,Wynn, R.,Burn, T.C.,Liu, P.C.C.,Combs, A.P.,Yue, E.W.
Isothiazolidinone Inhibitors of Ptp1B Containing Imidazoles and Imidazolines
Bioorg.Med.Chem.Lett., 18:66-, 2008
PubMed: 18037290 (PDB entries with the same primary citation)
DOI: 10.1016/J.BMCL.2007.11.012
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2 Å)
NMR Information
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Structure validation

ClashscoreRamachandran outliersSidechain outliersRSRZ outliers70.3%1.5%3.7%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution