PPIRE02458

Target Protein Information
Protein_Name Coagulation factor VII
Protein_Sequence MVSQALRLLCLLLGLQGCLAAGGVAKASGGETRDMPWKPGPHRVFVTQEEAHGVLHRRRRANAFLEELRPGSLERECKEEQCSFEEAREIFKDAERTKLFWISYSDGDQCASSPCQNGGSCKDQLQSYICFCLPAFEGRNCETHKDDQLICVNENGGCEQYCSDHTGTKRSCRCHEGYSLLADGVSCTPTVEYPCGKIPILEKRNASKPQGRIVGGKVCPKGECPWQVLLLVNGAQLCGGTLINTIWVVSAAHCFDKIKNWRNLIAVLGEHDLSEHDGDEQSRRVAQVIIPSTYVPGTTNHDIALLRLHQPVVLTDHVVPLCLPERTFSERTLAFVRFSLVSGWGQLLDRGATALELMVLNVPRLMTQDCLQQSRKVGDSPNITEYMFCAGYSDGSKDSCKGDSGGPHATHYRGTWYLTGIVSWGQGCATVGHFGVYTRVSQYIEWLQKLMRSEPRPGVLLRAPFP
Organism_Source Homo sapiens
Functional_Classification Enzyme
Cellular_Localization Extracellular
Gene_Names F7
UniProt_ID P08709
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name E-76
Peptide_Sequence ALCDDPRVDRWYCQFVEG
Peptide_Length 18
Peptide_SMILES CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)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](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)C(C)C)C(C)C
Chemical_Modification None
Cyclization_Method C3<->C13, side chain cyclization, disulfide bond
Linear/Cyclic Cyclic
N-terminal_Modification Acetyl
C-terminal_Modification amide
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 2172.42
Aliphatic_Index 59.44444
Aromaticity 0.16667
Average_Rotatable_Bonds 3.66667
Charge_at_pH_7 -2.12371
Isoelectric_Point 4.06266
Number_of_Hydrogen_Bond_Acceptors 29
Number_of_Hydrogen_Bond_Donors 33
Topological_Polar_Surface_Area 901.34000
X_logP_energy -6.98896
Interaction Information
Affinity IC50=7.4 nM
Affinity_Assay Enzyme Inhibition Kinetics
PDB_ID 1DVA
Type Inhibitor
Structure
Reference Information
Document_Type Research Articles
Title Peptide exosite inhibitors of factor VIIa as anticoagulants.
Release_Year 2000
PMID 10761907
DOI 10.1038/35006574