Human insulin in complex with cucurbit[7]uril

Summary for 3Q6E

DescriptorInsulin A chain, Insulin B chain, cucurbit[7]uril, ... (4 entities in total)
Functional Keywordsinsulin, cucurbit[7]uril, cucurbituril, synthetic, host, phenylalanine, supramolecular, recognition, carbohydrate metabolism, cleavage on pair of basic residues, diabetes mellitus, disease mutation, disulfide bond, glucose metabolism, hormone, secreted
Biological sourceHomo sapiens (human)
Cellular locationSecreted P01308 P01308
Total number of polymer chains4
Total molecular weight12798.26
Chinai, J.M.,Taylor, A.B.,Hargreaves, N.D.,Ryno, L.M.,Morris, C.A.,Hart, P.J.,Urbach, A.R. (deposition date: 2010-12-31, release date: 2011-04-20, Last modification date: 2014-02-19)
Primary citation
Chinai, J.M.,Taylor, A.B.,Ryno, L.M.,Hargreaves, N.D.,Morris, C.A.,Hart, P.J.,Urbach, A.R.
Molecular recognition of insulin by a synthetic receptor.
J.Am.Chem.Soc., 133:8810-8813, 2011
PubMed: 21473587 (PDB entries with the same primary citation)
DOI: 10.1021/ja201581x
MImport into Mendeley
Experimental method
NMR Information

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.252182.2%4.4%4.0%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation reportDownload