Crystal structure of the high affinity heterodimer of HIF2 alpha and ARNT C-terminal PAS domains with the artificial ligand THS017

Summary for 3H7W

Related3f1o 3f1p 3f1n 1P97 1X0O 2A24 2B02 3H82
DescriptorEndothelial PAS domain-containing protein 1, Aryl hydrocarbon receptor nuclear translocator, 2-nitro-N-(thiophen-3-ylmethyl)-4-(trifluoromethyl)aniline, ... (4 entities in total)
Functional Keywordspas domain, heterodimer, protein ligand complex., activator, angiogenesis, congenital erythrocytosis, developmental protein, differentiation, disease mutation, dna-binding, hydroxylation, nucleus, phosphoprotein, transcription, transcription regulation, ubl conjugation, alternative splicing, polymorphism
Biological sourceHomo sapiens (human)
Cellular locationNucleus (Potential) Q99814
Nucleus P27540
Total number of polymer chains2
Total molecular weight28083.67
Key, J.M.,Scheuermann, T.H.,Anderson, P.C.,Daggett, V.,Gardner, K.H. (deposition date: 2009-04-28, release date: 2010-01-12, Last modification date: 2011-07-13)
Primary citation
Key, J.,Scheuermann, T.H.,Anderson, P.C.,Daggett, V.,Gardner, K.H.
Principles of ligand binding within a completely buried cavity in HIF2alpha PAS-B
J.Am.Chem.Soc., 131:17647-17654, 2009
PubMed: 19950993 (PDB entries with the same primary citation)
DOI: 10.1021/ja9073062
MImport into Mendeley
Experimental method
NMR Information

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.237702.5%2.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution