THERMOSTABILISED HUMAN A2A RECEPTOR WITH NECA BOUND DOI:10.2210/pdb2ydv/pdb

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Primary Citation       Related Citations in PDB Entry (REMARK 1) Hide     Molecular Description Hide Classification: Receptor Structure Weight: 37873.46 Molecule: ADENOSINE RECEPTOR A2A Polymer: 1 Type: protein Length: 325 Chains: A Fragment: RESIDUES 1-317 Mutation: YES Organism Homo sapiens Gene Names ADORA2A ADORA2 UniProtKB:   Protein Feature View | Search PDB | P29274         Source Hide Polymer: 1 Scientific Name: Homo sapiens   Taxonomy   Common Name: Human Expression System: Trichoplusia ni       Related PDB Entries Hide Identifier Details 1MMH  MOLECULAR MODEL OF THE HUMAN A2A ADENOSINE RECEPTOR  1UPE  MODELING THE ADENOSINE RECEPTORS: COMPARISON OF THE BINDING DOMAINS OF A2A AGONISTS AND ANTAGONISTS  2YDO  THERMOSTABILISED HUMAN A2A RECEPTOR WITH ADENOSINE BOUND      Ligand Chemical Component Hide Identifier Formula Name Interactions NEC Search  Download  C12 H16 N6 O4 N-ETHYL-5'-CARBOXAMIDO ADENOSINE   Ligand Explorer SOG Search  Download  C14 H28 O5 S 2-HYDROXYMETHYL-6-OCTYLSULFANYL-TETRAHYDRO- PYRAN-3,4,5-TRIOL   Ligand Explorer     External Ligand Annotations Hide Identifier   Binding Affinity (Sequence Identity %) NEC Search  Download  EC50: 17.6 - 394 nM (88 - 97) - data from BindingDB   IC50: 7.05 - 366 nM (88 - 97) - data from BindingDB   Ki: 1 - >10000 nM (88 - 97) - data from BindingDB   N/A in BindingMoad Ki: 13.8 nM - data from PDBbind       External Domain Annotations Hide Pfam Classification: 3 Domains - data from Pfam   GO Terms: 80 Terms - data from GO      Structural Biology Knowledgebase Data Hide     Data in orange boxes are gathered from external resources (when available). Reset Layout

Biological Assembly            View in 3D More Images... Biological assembly 1 assigned by authors and generated by PISA (software) Downloadable viewers: Simple Viewer Protein Workshop Ligand Explorer Kiosk Viewer Other Viewers  KiNG WebMol QuickPDB FirstGlance         MyPDB Personal Annotations Hide     Deposition Summary Hide Authors:   Lebon, G.,  Warne, T.,  Edwards, P.C.,  Bennett, K.,  Langmead, C.J.,  Leslie, A.G.W.,  Tate, C.G. Deposition:   2011-03-24 Release:   2011-05-18 Last Modified (REVDAT):   2011-06-22     Revision History    Hide Mouse over text for details 2011-07-13 Version format compliance     Experimental Details Hide Method:   X-RAY DIFFRACTION Exp. Data:   Structure Factors EDS   Resolution[Å]:   2.60 R-Value: 0.234 (obs.) R-Free: 0.258 Space Group: C 2 Unit Cell:   Length [Å] Angles [°] a = 76.94 α = 90.00  b = 99.55 β = 93.31  c = 79.65 γ = 90.00