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GPCR

NameVasoactive intestinal polypeptide receptor 2
SpeciesRattus norvegicus (Rat)
GeneVipr2
SynonymVIP-R-2
VIP and PACAP receptor 2
PVR3
Pituitary adenylate cyclase-activating polypeptide type III receptor
PACAP-R3
[ Show all ]
DiseaseN/A for non-human GPCRs
Length437
Amino acid sequenceMRASVVLTCYCWLLVRVSSIHPECRFHLEIQEEETKCAELLSSQMENHRACSGVWDNITCWRPADIGETVTVPCPKVFSNFYSRPGNISKNCTSDGWSETFPDFIDACGYNDPEDESKITFYILVKAIYTLGYSVSLMSLTTGSIIICLFRKLHCTRNYIHLNLFLSFMLRAISVLVKDSVLYSSSGTLRCHDQPGSWVGCKLSLVFFQYCIMANFYWLLVEGLYLHTLLVAILPPSRCFLAYLLIGWGIPSVCIGAWIATRLSLEDTGCWDTNDHSIPWWVIRMPILISIVVNFALFISIVRILLQKLTSPDVGGNDQSQYKRLAKSTLLLIPLFGVHYMVFAAFPIGISSTYQILFELCVGSFQGLVVAVLYCFLNSEVQCELKRRWRGLCLTQPGSRDYRLHSWSMSRNGSESALQIHRGSRTQSFLQSETSVI
UniProtP35000
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLN/A
IUPHAR372
DrugBankN/A

Ligand

NameVIP Ala2
Molecular formulaC147H240N44O40S
IUPAC name(3S)-4-[[(2S)-4-amino-1-[[(2S)-1-[[(3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1,4-diamino-1,4-dioxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoic acid
Molecular weight3295.86
Hydrogen bond acceptor48
Hydrogen bond donor48
XlogP-11.4
SynonymsBDBM85873
Inchi KeyLGBFBZARGQGZJC-BBVMAOHWSA-N
Inchi IDInChI=1S/C147H240N44O40S/c1-20-75(12)114(142(228)182-99(58-72(6)7)131(217)175-96(118(156)204)63-108(153)199)188-139(225)106(68-192)185-135(221)104(65-110(155)201)180-132(218)98(57-71(4)5)177-133(219)100(60-83-39-43-86(196)44-40-83)178-127(213)90(35-25-28-51-149)169-125(211)91(36-26-29-52-150)173-140(226)112(73(8)9)186-119(205)77(14)166-123(209)95(49-55-232-19)172-129(215)94(47-48-107(152)198)171-124(210)89(34-24-27-50-148)168-126(212)92(37-30-53-162-146(157)158)170-130(216)97(56-70(2)3)176-128(214)93(38-31-54-163-147(159)160)174-144(230)116(80(17)194)190-137(223)101(61-84-41-45-87(197)46-42-84)179-134(220)103(64-109(154)200)181-136(222)105(66-111(202)203)184-145(231)117(81(18)195)191-138(224)102(59-82-32-22-21-23-33-82)183-141(227)113(74(10)11)187-120(206)78(15)167-143(229)115(79(16)193)189-121(207)76(13)165-122(208)88(151)62-85-67-161-69-164-85/h21-23,32-33,39-46,67,69-81,88-106,112-117,192-197H,20,24-31,34-38,47-66,68,148-151H2,1-19H3,(H2,152,198)(H2,153,199)(H2,154,200)(H2,155,201)(H2,156,204)(H,161,164)(H,165,208)(H,166,209)(H,167,229)(H,168,212)(H,169,211)(H,170,216)(H,171,210)(H,172,215)(H,173,226)(H,174,230)(H,175,217)(H,176,214)(H,177,219)(H,178,213)(H,179,220)(H,180,218)(H,181,222)(H,182,228)(H,183,227)(H,184,231)(H,185,221)(H,186,205)(H,187,206)(H,188,225)(H,189,207)(H,190,223)(H,191,224)(H,202,203)(H4,157,158,162)(H4,159,160,163)/t75-,76-,77-,78-,79?,80+,81+,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,112-,113-,114-,115-,116?,117-/m0/s1
PubChem CID91899016
ChEMBLN/A
IUPHARN/A
BindingDB85873
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
Ki0.32 nMPMID12388623BindingDB
Ki3.2 nMPMID12388623BindingDB

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