PPIRE17803

Target Protein Information
Protein_Name Virulence-associated V antigen
Protein_Sequence MIRAYEQNPQHFIEDLEKVRVEQLTGHGSSVLEELVQLVKDKNIDISIKYDPRKDSEVFANRVITDDIELLKKILAYFLPEDAILKGGHYDNQLQNGIKRVKEFLESSPNTQWELRAFMAVMHFSLTADRIDDDILKVIVDSMNHHGDARSKLREELAELTAELKIYSVIQAEINKHLSSSGTINIHDKSINLMDKNLYGYTDEEIFKASAEYKILEKMPQTTIQVDGSEKKIVSIKDFLGSENKRTGALGNLKNSYSYNKDNNELSHFATTCSDKSRPLNDLVSQKTTQLSDITSRFNSAIEALNRFIQKYDSVMQRLLDDTSGK
Organism_Source Yersinia pestis
Functional_Classification Bacterial toxins V antigen pore forming modulator
Cellular_Localization Extracellular
Gene_Names lcrV
UniProt_ID P0C7U7
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name Peptide b
Peptide_Sequence ISIKYDPRKDSEVFA
Peptide_Length 15
Peptide_SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)CC
Chemical_Modification None
Cyclization_Method None
Linear/Cyclic Linear
N-terminal_Modification Free
C-terminal_Modification Free
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 1768.00
Aliphatic_Index 78.00000
Aromaticity 0.13333
Average_Rotatable_Bonds 3.86667
Charge_at_pH_7 -0.00079
Isoelectric_Point 6.54749
Number_of_Hydrogen_Bond_Acceptors 25
Number_of_Hydrogen_Bond_Donors 26
Topological_Polar_Surface_Area 748.46000
X_logP_energy -6.02913
Interaction Information
Affinity IC50=12 uM
Affinity_Assay ELISA
PDB_ID 1R6F
Type Affinity ligand
Structure
Reference Information
Document_Type Research Articles
Title Identifying B and T cell epitopes and studying humoral mucosal and cellular immune responses of peptides derived from V antigen of Yersinia pestis
Release_Year 2008
PMID 18096277
DOI 10.1016/j.vaccine.2007.11.028