Crystal structure of the complex between PPARgamma-LBD and the R enantiomer of Mbx-102 (Metaglidasen)

Summary for 4PVU

DescriptorPeroxisome proliferator-activated receptor gamma, (2R)-(4-chlorophenyl)[3-(trifluoromethyl)phenoxy]ethanoic acid (3 entities in total)
Functional Keywordsalpha-helices, small four-stranded beta-sheet, activator, tdna-binding, nucleus, obesity, receptor, transcription, transcription regulation
Biological sourceHomo sapiens (human)
Cellular locationNucleus P37231
Total number of polymer chains2
Total molecular weight65718.33
Pochetti, G.,Montanari, R.,Capelli, D.,Loiodice, F.,Laghezza, A.,Piemontese, L.,Lavecchia, A. (deposition date: 2014-03-18, release date: 2015-02-11)
Primary citation
Laghezza, A.,Montanari, R.,Lavecchia, A.,Piemontese, L.,Pochetti, G.,Iacobazzi, V.,Infantino, V.,Capelli, D.,De Bellis, M.,Liantonio, A.,Pierno, S.,Tortorella, P.,Conte Camerino, D.,Loiodice, F.
On the Metabolically Active Form of Metaglidasen: Improved Synthesis and Investigation of Its Peculiar Activity on Peroxisome Proliferator-Activated Receptors and Skeletal Muscles.
Chemmedchem, 2015
PubMed: 25641779 (PDB entries with the same primary citation)
DOI: 10.1002/cmdc.201402462
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.254111.4%6.6%5.7%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation report