Crystal structure of HIV-1 reverse transcriptase (RT) in complex with R221239

Summary for 2BE2

Related2BAN 2B5J
Related PRD IDPRD_900003
DescriptorREVERSE TRANSCRIPTASE P66 SUBUNIT, REVERSE TRANSCRIPTASE P51 SUBUNIT, beta-D-fructofuranose-(2-1)-alpha-D-glucopyranose, ... (7 entities in total)
Functional Keywordsaids, hiv, drug design, reverse transcriptase, rt, protein-inhibitor complex, drug resistance, transferase
Biological sourceHuman immunodeficiency virus 1
Cellular locationGag-Pol polyprotein: Host cell membrane; Lipid-anchor. Matrix protein p17: Virion membrane; Lipid- anchor . Capsid protein p24: Virion . Nucleocapsid protein p7: Virion . Reverse transcriptase/ribonuclease H: Virion . Integrase: Virion  P03366 P03366
Total number of polymer chains2
Total molecular weight116187.79
Primary citation
Himmel, D.M.,Das, K.,Clark Jr., A.D.,Hughes, S.H.,Benjahad, A.,Oumouch, S.,Guillemont, J.,Coupa, S.,Poncelet, A.,Csoka, I.,Meyer, C.,Andries, K.,Nguyen, C.H.,Grierson, D.S.,Arnold, E.
Crystal Structures for HIV-1 Reverse Transcriptase in Complexes with Three Pyridinone Derivatives: A New Class of Non-Nucleoside Inhibitors Effective against a Broad Range of Drug-Resistant Strains.
J.Med.Chem., 48:7582-7591, 2005
PubMed: 16302798 (PDB entries with the same primary citation)
DOI: 10.1021/jm0500323
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.25829 1.5% 7.0% 10.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
Download full validation reportDownload
PDB entries from 2020-10-21