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

You can:

GPCR

NameGalanin receptor type 3
SpeciesRattus norvegicus (Rat)
GeneGalr3
SynonymGAL3 receptor
GAL3-R
Galnr3
GALR-3
GALR3
DiseaseN/A for non-human GPCRs
Length370
Amino acid sequenceMADIQNISLDSPGSVGAVAVPVIFALIFLLGMVGNGLVLAVLLQPGPSAWQEPRSTTDLFILNLAVADLCFILCCVPFQAAIYTLDAWLFGAFVCKTVHLLIYLTMYASSFTLAAVSLDRYLAVRHPLRSRALRTPRNARAAVGLVWLLAALFSAPYLSYYGTVRYGALELCVPAWEDARRRALDVATFAAGYLLPVAVVSLAYGRTLCFLWAAVGPAGAAAAEARRRATGRAGRAMLAVAALYALCWGPHHALILCFWYGRFAFSPATYACRLASHCLAYANSCLNPLVYSLASRHFRARFRRLWPCGRRRHRHHHRAHRALRRVQPASSGPAGYPGDARPRGWSMEPRGDALRGGGETRLTLSPRGPQ
UniProtO88626
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLN/A
IUPHARN/A
DrugBankN/A

Ligand

NameGalanin (1-29), rat
Molecular formulaC137H204N42O39
IUPAC name3-[[2-[[2-[[2-[[2-[[2-[[4-amino-2-[[2-[[2-[2-[[2-[[1-[2-[[2-[[2-[[2-[[2-[2-[[2-[[4-amino-2-[[2-[[2-[[2-[(2-aminoacetyl)amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]propanoylamino]acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoylamino]-3-methylpentanoyl]amino]-3-carboxypropanoyl]amino]-4-oxobutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-4-[[6-amino-1-[[1-[[2-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-2-oxoethyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-oxobutanoic acid
Molecular weight3063.39
Hydrogen bond acceptor45
Hydrogen bond donor44
XlogP-13.6
SynonymsBDBM85164
Inchi KeyXHLNFXMYVKWJPE-UHFFFAOYSA-N
Inchi IDInChI=1S/C137H204N42O39/c1-14-70(10)111(135(217)173-98(51-110(193)194)129(211)169-95(48-103(140)185)126(208)167-94(47-79-56-147-65-155-79)125(207)162-84(29-22-36-148-137(143)144)119(201)174-100(61-181)132(214)165-90(42-74-24-16-15-17-25-74)124(206)176-101(62-182)133(215)170-97(50-109(191)192)128(210)161-83(28-20-21-35-138)118(200)166-92(45-77-54-145-63-153-77)117(199)151-58-106(188)158-85(113(142)195)38-66(2)3)177-115(197)72(12)157-120(202)93(46-78-55-146-64-154-78)171-134(216)102-30-23-37-179(102)108(190)59-152-116(198)86(39-67(4)5)163-121(203)87(40-68(6)7)164-123(205)89(43-75-31-33-80(184)34-32-75)160-107(189)57-150-114(196)71(11)156-131(213)99(60-180)175-127(209)96(49-104(141)186)168-122(204)88(41-69(8)9)172-136(218)112(73(13)183)178-130(212)91(159-105(187)52-139)44-76-53-149-82-27-19-18-26-81(76)82/h15-19,24-27,31-34,53-56,63-73,83-102,111-112,149,180-184H,14,20-23,28-30,35-52,57-62,138-139H2,1-13H3,(H2,140,185)(H2,141,186)(H2,142,195)(H,145,153)(H,146,154)(H,147,155)(H,150,196)(H,151,199)(H,152,198)(H,156,213)(H,157,202)(H,158,188)(H,159,187)(H,160,189)(H,161,210)(H,162,207)(H,163,203)(H,164,205)(H,165,214)(H,166,200)(H,167,208)(H,168,204)(H,169,211)(H,170,215)(H,171,216)(H,172,218)(H,173,217)(H,174,201)(H,175,209)(H,176,206)(H,177,197)(H,178,212)(H,191,192)(H,193,194)(H4,143,144,148)
PubChem CID91898924
ChEMBLN/A
IUPHARN/A
BindingDB85164
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis 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

ParameterValueReferenceDatabase source
Ki1.47 nMPMID9405385BindingDB

yangzhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218