P-glycoprotein co-crystallized with BDE-100

Summary for 4XWK

DescriptorMultidrug resistance protein 1A, 2,4-dibromophenyl 2,4,6-tribromophenyl ether (2 entities in total)
Functional Keywordsmembrane protein, transporter, hydrolase
Biological sourceMus musculus (Mouse)
Total number of polymer chains1
Total molecular weight142484.64
McGrath, A.P.,Rees, S.D.,Chang, G. (deposition date: 2015-01-28, release date: 2016-04-27, Last modification date: 2019-12-18)
Primary citation
Nicklisch, S.C.,Rees, S.D.,McGrath, A.P.,Gokirmak, T.,Bonito, L.T.,Vermeer, L.M.,Cregger, C.,Loewen, G.,Sandin, S.,Chang, G.,Hamdoun, A.
Global marine pollutants inhibit P-glycoprotein: Environmental levels, inhibitory effects, and cocrystal structure.
Sci Adv, 2:e1600001-e1600001, 2016
PubMed: 27152359 (PDB entries with the same primary citation)
DOI: 10.1126/sciadv.1600001
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.28350 0.7% 2.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation reportDownload
PDB entries from 2020-09-23