Zhang Lab

National University of Singapore

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
Go back to previous page.

GPCR

Name	Metabotropic glutamate receptor 2
Species	Rattus norvegicus (Rat)
Gene	Grm2
Synonym	glutamate receptor GPRC1B metabotropic glutamate receptor 2 mGlu2 receptor mGluR2
Disease	N/A for non-human GPCRs
Length	872
Amino acid sequence	MESLLGFLALLLLWGAVAEGPAKKVLTLEGDLVLGGLFPVHQKGGPAEECGPVNEHRGIQRLEAMLFALDRINRDPHLLPGVRLGAHILDSCSKDTHALEQALDFVRASLSRGADGSRHICPDGSYATHSDAPTAVTGVIGGSYSDVSIQVANLLRLFQIPQISYASTSAKLSDKSRYDYFARTVPPDFFQAKAMAEILRFFNWTYVSTVASEGDYGETGIEAFELEARARNICVATSEKVGRAMSRAAFEGVVRALLQKPSARVAVLFTRSEDARELLAATQRLNASFTWVASDGWGALESVVAGSERAAEGAITIELASYPISDFASYFQSLDPWNNSRNPWFREFWEERFHCSFRQRDCAAHSLRAVPFEQESKIMFVVNAVYAMAHALHNMHRALCPNTTHLCDAMRPVNGRRLYKDFVLNVKFDAPFRPADTDDEVRFDRFGDGIGRYNIFTYLRAGSGRYRYQKVGYWAEGLTLDTSFIPWASPSAGPLPASRCSEPCLQNEVKSVQPGEVCCWLCIPCQPYEYRLDEFTCADCGLGYWPNASLTGCFELPQEYIRWGDAWAVGPVTIACLGALATLFVLGVFVRHNATPVVKASGRELCYILLGGVFLCYCMTFVFIAKPSTAVCTLRRLGLGTAFSVCYSALLTKTNRIARIFGGAREGAQRPRFISPASQVAICLALISGQLLIVAAWLVVEAPGTGKETAPERREVVTLRCNHRDASMLGSLAYNVLLIALCTLYAFKTRKCPENFNEAKFIGFTMYTTCIIWLAFLPIFYVTSSDYRVQTTTMCVSVSLSGSVVLGCLFAPKLHIILFQPQKNVVSHRAPTSRFGSAAPRASANLGQGSGSQFVPTVCNGREVVDSTTSSL
UniProt	P31421
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2851
IUPHAR	290
DrugBank	N/A

Ligand

Name	(RS)-MCPG
Molecular formula	C10H11NO4
IUPAC name	4-(1-amino-1-carboxyethyl)benzoic acid
Molecular weight	209.201
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	-2.0
Synonyms	4-(1-Amino-1-carboxy-ethyl)-benzoic acid(S-M4CPG) alpha-Amino-4-carboxy-alpha-methylbenzeneacetic acid BN0322 HMS3262E16 M 4796 NCGC00024542-03 Tox21_500747 (?)-alpha-Methyl-4-carboxyphenylglycine BCP18268 KS-00001CLO NCGC00015676-03 RT-015311 (+-)-MCPG (RS)-?-Methyl-4-carboxyphenylglycine ACMC-20cchr Benzeneacetic acid, alpha-amino-4-carboxy-alpha-methyl- CTK4C5052 LP00747 NCGC00015676-06 SR-01000075733-1 (+/-)-MCPG 4-(1-amino-1-carboxyethyl)benzoic acid alpha-Methyl-2-(4-carboxyphenyl)glycine C10H11NO4 HY-100371 MFCD00210205 NCGC00024542-04 ( inverted question mark)-alpha-Methyl-4-carboxyphenylglycine (r,s)-alpha-methyl-4-carboxyphenylglycine AC1L1AZT BDBM50030627 CHEMBL299683 L000020 NCGC00015676-04 SCHEMBL715285 (+/-)-alpha-Methyl-(4-carboxyphenyl)glycine 146669-29-6 AKOS005066801 Benzeneacetic acid, alpha-amino-4-carboxy-alpha-methyl-, (+-)- EU-0100747 LS-173280 NCGC00024542-02 ST50825577 (+/-)MCPG 4-(2-amino-1-hydroxy-1-oxopropan-2-yl)benzoic acid alpha-Methyl-4-carboxyphenylglycine CCG-204832 J-008240 MolPort-003-958-752 NCGC00261432-01 ( inverted question mark)-MCPG (R,S)-MCPG (y)-alpha-Methyl-4-carboxyphenylglycine AC1Q5S1R Benzeneacetic acid, a-amino-4-carboxy-a-methyl- CS-5708 Lopac0_000747 NCGC00015676-05 SR-01000075733 (+/-)-alpha-Methyl-4-carboxyphenylglycine [ Show all ]
Inchi Key	DNCAZYRLRMTVSF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H11NO4/c1-10(11,9(14)15)7-4-2-6(3-5-7)8(12)13/h2-5H,11H2,1H3,(H,12,13)(H,14,15)
PubChem CID	1222
ChEMBL	CHEMBL299683
IUPHAR	N/A
BindingDB	50030627
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	290000.0 nM	PMID11459661	BindingDB,ChEMBL

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417