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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	P2Y purinoceptor 11
Species	Homo sapiens (Human)
Gene	P2RY11
Synonym	P2Y11 P2Y11 receptor purinergic receptor P2Y, G-protein coupled, 11
Disease	N/A
Length	374
Amino acid sequence	MAANVSGAKSCPANFLAAADDKLSGFQGDFLWPILVVEFLVAVASNGLALYRFSIRKQRPWHPAVVFSVQLAVSDLLCALTLPPLAAYLYPPKHWRYGEAACRLERFLFTCNLLGSVIFITCISLNRYLGIVHPFFARSHLRPKHAWAVSAAGWVLAALLAMPTLSFSHLKRPQQGAGNCSVARPEACIKCLGTADHGLAAYRAYSLVLAGLGCGLPLLLTLAAYGALGRAVLRSPGMTVAEKLRVAALVASGVALYASSYVPYHIMRVLNVDARRRWSTRCPSFADIAQATAALELGPYVGYQVMRGLMPLAFCVHPLLYMAAVPSLGCCCRHCPGYRDSWNPEDAKSTGQALPLNATAAPKPSEPQSRELSQ
UniProt	Q96G91
Protein Data Bank	N/A
GPCR-HGmod model	Q96G91
3D structure model	This predicted structure model is from GPCR-EXP Q96G91.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4867
IUPHAR	327
DrugBank	BE0005499

Ligand

Name	2-Mesatp
Molecular formula	C11H18N5O13P3S
IUPAC name	[[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight	553.268
Hydrogen bond acceptor	18
Hydrogen bond donor	7
XlogP	-4.9
Synonyms	2-(methylthio)adenosine 5'-(tetrahydrogen triphosphate) 2-methylthioadenosine 5'-triphosphate BDBM50118232 SCHEMBL375601 2-Methyl-thio-ATP CTK7B5306 ZINC3995334 2-(methylthio) adenosine 5'-triphosphate 2-methylthio-adenosine-5'-triphosphate AKOS027379934 GTPL1711 2-(METHYLTHIO)ADENOSINE-5'-TRIPHOSPHATE 2MeSATP UNII-Y37441OBL1 2-Methylthio ATP 6AT D0U1OJ [(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate 2-(Methylthio)-Adenosinetriphosphate 2-Methylthio-ATP ATP, 2-meS NCGC00163310-01 43170-89-4 CHEMBL336208 Y37441OBL1 2-(methylsulfanyl)adenosine 5'-(tetrahydrogen triphosphate) 2-Methylthio ATP tetrasodium AC1NSJRQ DTXSID6037146 [[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate [ Show all ]
Inchi Key	XNOBOKJVOTYSJV-KQYNXXCUSA-N
Inchi ID	InChI=1S/C11H18N5O13P3S/c1-33-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(27-10)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1
PubChem CID	5310983
ChEMBL	CHEMBL336208
IUPHAR	1711
BindingDB	50118232
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	50000.0 nM	PMID12213051	BindingDB,ChEMBL
EC50	50118.7 - 199526.0 nM	PMID10578132	IUPHAR

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