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GPCR

NameVasoactive intestinal polypeptide receptor 2
SpeciesHomo sapiens (Human)
GeneVIPR2
SynonymVPAC2
VIP-R-2
VIP and PACAP receptor 2
PVR3
Pituitary adenylate cyclase-activating polypeptide type III receptor
[ Show all ]
DiseaseUnspecified
Chronic obstructive pulmonary disease
Hypertension
Length438
Amino acid sequenceMRTLLPPALLTCWLLAPVNSIHPECRFHLEIQEEETKCAELLRSQTEKHKACSGVWDNITCWRPANVGETVTVPCPKVFSNFYSKAGNISKNCTSDGWSETFPDFVDACGYSDPEDESKITFYILVKAIYTLGYSVSLMSLATGSIILCLFRKLHCTRNYIHLNLFLSFILRAISVLVKDDVLYSSSGTLHCPDQPSSWVGCKLSLVFLQYCIMANFFWLLVEGLYLHTLLVAMLPPRRCFLAYLLIGWGLPTVCIGAWTAARLYLEDTGCWDTNDHSVPWWVIRIPILISIIVNFVLFISIIRILLQKLTSPDVGGNDQSQYKRLAKSTLLLIPLFGVHYMVFAVFPISISSKYQILFELCLGSFQGLVVAVLYCFLNSEVQCELKRKWRSRCPTPSASRDYRVCGSSFSRNGSEGALQFHRGSRAQSFLQTETSVI
UniProtP41587
Protein Data BankN/A
GPCR-HGmod modelP41587
3D structure modelThis predicted structure model is from GPCR-EXP P41587.
BioLiPN/A
Therapeutic Target DatabaseT06182
ChEMBLCHEMBL4532
IUPHAR372
DrugBankN/A

Ligand

NameCID 76328238
Molecular formulaC160H257N45O45
IUPAC name(2S)-6-amino-2-[[2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,5S,8S,11S,16Z,22S)-22-[[(2S)-5-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]-3-carboxypropanoyl]amino]-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-5-oxopentanoyl]amino]-8-(4-aminobutyl)-2,11,22-trimethyl-3,6,9,23-tetraoxo-5-propan-2-yl-1,4,7,10-tetrazacyclotricos-16-ene-11-carbonyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoyl]amino]acetyl]amino]hexanoic acid
Molecular weight3531.09
Hydrogen bond acceptor52
Hydrogen bond donor53
XlogP-14.1
SynonymsN/A
Inchi KeyFIRKJCSBLJUSKS-ZOJSJWDJSA-N
Inchi IDInChI=1S/C160H257N45O45/c1-19-85(12)125(151(244)193-105(65-82(6)7)138(231)189-109(70-117(166)213)131(224)176-76-120(216)180-102(154(247)248)43-31-36-60-163)201-146(239)115(78-207)197-141(234)111(72-119(168)215)190-137(230)104(64-81(4)5)187-139(232)108(68-92-48-52-95(211)53-49-92)198-156(250)160(18)57-33-25-23-21-20-22-24-32-56-159(17,155(249)179-87(14)129(222)200-123(83(8)9)149(242)185-100(147(240)204-160)42-30-35-59-162)205-148(241)101(54-55-116(165)212)183-132(225)97(41-29-34-58-161)181-133(226)98(44-37-61-174-157(169)170)182-136(229)103(63-80(2)3)186-134(227)99(45-38-62-175-158(171)172)184-152(245)126(88(15)208)202-143(236)106(67-91-46-50-94(210)51-47-91)188-140(233)110(71-118(167)214)191-142(235)113(74-122(219)220)195-153(246)127(89(16)209)203-144(237)107(66-90-39-27-26-28-40-90)194-150(243)124(84(10)11)199-128(221)86(13)178-135(228)112(73-121(217)218)192-145(238)114(77-206)196-130(223)96(164)69-93-75-173-79-177-93/h20-21,26-28,39-40,46-53,75,79-89,96-115,123-127,206-211H,19,22-25,29-38,41-45,54-74,76-78,161-164H2,1-18H3,(H2,165,212)(H2,166,213)(H2,167,214)(H2,168,215)(H,173,177)(H,176,224)(H,178,228)(H,179,249)(H,180,216)(H,181,226)(H,182,229)(H,183,225)(H,184,245)(H,185,242)(H,186,227)(H,187,232)(H,188,233)(H,189,231)(H,190,230)(H,191,235)(H,192,238)(H,193,244)(H,194,243)(H,195,246)(H,196,223)(H,197,234)(H,198,250)(H,199,221)(H,200,222)(H,201,239)(H,202,236)(H,203,237)(H,204,240)(H,205,241)(H,217,218)(H,219,220)(H,247,248)(H4,169,170,174)(H4,171,172,175)/b21-20-/t85-,86-,87-,88+,89+,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,123-,124-,125-,126-,127-,159-,160-/m0/s1
PubChem CID76328238
ChEMBLCHEMBL3102931
IUPHARN/A
BindingDB50445116
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
EC500.33 nMPMID24900623BindingDB,ChEMBL

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