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Name | P2Y purinoceptor 13 |
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Species | Homo sapiens (Human) |
Gene | P2RY13 |
Synonym | G-protein coupled receptor 86 purinergic receptor P2Y, G-protein coupled 13 purinergic receptor P2Y P2Y13 receptor P2Y13 [ Show all ] |
Disease | N/A |
Length | 354 |
Amino acid sequence | MTAAIRRQRELSILPKVTLEAMNTTVMQGFNRSERCPRDTRIVQLVFPALYTVVFLTGILLNTLALWVFVHIPSSSTFIIYLKNTLVADLIMTLMLPFKILSDSHLAPWQLRAFVCRFSSVIFYETMYVGIVLLGLIAFDRFLKIIRPLRNIFLKKPVFAKTVSIFIWFFLFFISLPNTILSNKEATPSSVKKCASLKGPLGLKWHQMVNNICQFIFWTVFILMLVFYVVIAKKVYDSYRKSKSKDRKNNKKLEGKVFVVVAVFFVCFAPFHFARVPYTHSQTNNKTDCRLQNQLFIAKETTLFLAATNICMDPLIYIFLCKKFTEKLPCMQGRKTTASSQENHSSQTDNITLG |
UniProt | Q9BPV8 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9BPV8 |
3D structure model | This predicted structure model is from GPCR-EXP Q9BPV8. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | N/A |
IUPHAR | 329 |
DrugBank | N/A |
Name | ATPgammaS |
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Molecular formula | C10H12N5O12P3S-4 |
IUPAC name | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] dioxidophosphinothioyl phosphate |
Molecular weight | 519.21 |
Hydrogen bond acceptor | 17 |
Hydrogen bond donor | 3 |
XlogP | -4.3 |
Synonyms | D0S3WN Adenosine- 5'- O- (3- thiotriphosphate) GTPL1714 [5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (dioxidophosphinothioyloxy-oxidophosphoryl) phosphate 93839-89-5 |
Inchi Key | NLTUCYMLOPLUHL-KQYNXXCUSA-J |
Inchi ID | InChI=1S/C10H16N5O12P3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(25-10)1-24-28(18,19)26-29(20,21)27-30(22,23)31/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)(H2,22,23,31)/p-4/t4-,6-,7-,10-/m1/s1 |
PubChem CID | 44123300 |
ChEMBL | N/A |
IUPHAR | 1714 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
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IC50 | 3162.28 nM | PMID12815166 | IUPHAR |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417