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GPCR

NameC5a anaphylatoxin chemotactic receptor 1
SpeciesHomo sapiens (Human)
GeneC5AR1
SynonymCD88
complement component 5a receptor 1
C5a anaphylatoxin chemotactic receptor
C5aR1
C5R1
[ Show all ]
DiseaseVasculitis
Rheumatoid arthritis
Inflammatory disease
Atopic dermatitis
Length350
Amino acid sequenceMDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVWVTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNMYASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREEYFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKTLKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIYVVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV
UniProtP21730
Protein Data Bank6c1q, 6c1r, 5o9h
GPCR-HGmod modelP21730
3D structure modelThis structure is from PDB ID 6c1q.
BioLiPBL0415512, BL0415513, BL0415514, BL0401194,BL0401195,BL0401196,, BL0415511
Therapeutic Target DatabaseT15439
ChEMBLCHEMBL2373
IUPHAR32
DrugBankN/A

Ligand

NameBDBM50290485
Molecular formulaC29H36N6O4
IUPAC name2-[3-[4-hydroxy-3-[(2R)-3-(4-hydroxyphenyl)-1-oxo-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropan-2-yl]-2-oxo-1H-imidazol-5-yl]propyl]guanidine
Molecular weight532.645
Hydrogen bond acceptor5
Hydrogen bond donor5
XlogP2.2
Synonyms5-[3-amino(imino)methylaminopropyl]-3-[1-(4-hydroxybenzyl)-2-oxo-2-spiro[2,3-dihydro-1H-indene-1,4''-(hexahydropyridine)]-1-yl-(1R)-ethyl]-(5R)-tetrahydro-1H-2,4-imidazoledione
Inchi KeyBKRPHWPSTZZSOG-XMMPIXPASA-N
Inchi IDInChI=1S/C29H36N6O4/c30-27(31)32-15-3-6-23-25(37)35(28(39)33-23)24(18-19-7-9-21(36)10-8-19)26(38)34-16-13-29(14-17-34)12-11-20-4-1-2-5-22(20)29/h1-2,4-5,7-10,24,36-37H,3,6,11-18H2,(H,33,39)(H4,30,31,32)/t24-/m1/s1
PubChem CID91934582
ChEMBLN/A
IUPHARN/A
BindingDB50290485
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
IC504000.0 nMN/ABindingDB

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