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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	P2Y purinoceptor 6
Species	Homo sapiens (Human)
Gene	P2RY6
Synonym	pyrimidinergic receptor P2Y P2Y6 receptor P2Y6 P2Y purinoceptor 6 P2Y ATP receptor 6 uridine nucleotide receptor [ Show all ]
Disease	N/A
Length	328
Amino acid sequence	MEWDNGTGQALGLPPTTCVYRENFKQLLLPPVYSAVLAAGLPLNICVITQICTSRRALTRTAVYTLNLALADLLYACSLPLLIYNYAQGDHWPFGDFACRLVRFLFYANLHGSILFLTCISFQRYLGICHPLAPWHKRGGRRAAWLVCVAVWLAVTTQCLPTAIFAATGIQRNRTVCYDLSPPALATHYMPYGMALTVIGFLLPFAALLACYCLLACRLCRQDGPAEPVAQERRGKAARMAVVVAAAFAISFLPFHITKTAYLAVRSTPGVPCTVLEAFAAAYKGTRPFASANSVLDPILFYFTQKKFRRRPHELLQKLTAKWQRQGR
UniProt	Q15077
Protein Data Bank	N/A
GPCR-HGmod model	Q15077
3D structure model	This predicted structure model is from GPCR-EXP Q15077.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4714
IUPHAR	326
DrugBank	N/A

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)-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 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 [ 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	100000.0 nM	PMID8670200, PMID12213051	BindingDB,IUPHAR,ChEMBL

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