PPIRE04567

Target Protein Information
Protein_Name Amine oxidase [flavin-containing] A
Protein_Sequence MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGGRTYTIRNEHVDYVDVGGAYVGPTQNRILRLSKELGIETYKVNVSERLVQYVKGKTYPFRGAFPPVWNPIAYLDYNNLWRTIDNMGKEIPTDAPWEAQHADKWDKMTMKELIDKICWTKTARRFAYLFVNINVTSEPHEVSALWFLWYVKQCGGTTRIFSVTNGGQERKFVGGSGQVSERIMDLLGDQVKLNHPVTHVDQSSDNIIIETLNHEHYECKYVINAIPPTLTAKIHFRPELPAERNQLIQRLPMGAVIKCMMYYKEAFWKKKDYCGCMIIEDEDAPISITLDDTKPDGSLPAIMGFILARKADRLAKLHKEIRKKKICELYAKVLGSQEALHPVHYEEKNWCEEQYSGGCYTAYFPPGIMTQYGRVIRQPVGRIFFAGTETATKWSGYMEGAVEAGERAAREVLNGLGKVTEKDIWVQEPESKDVPAVEITHTFWERNLPSVSGLLKIIGFSTSVTALGFVLYKYKLLPRS
Organism_Source Homo sapiens
Functional_Classification oxidoreductases
Cellular_Localization Mitochondrion
Gene_Names MAOA
UniProt_ID P21397
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name WGF
Peptide_Sequence WGF
Peptide_Length 3
Peptide_SMILES N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O
Chemical_Modification None
Cyclization_Method None
Linear/Cyclic Linear
N-terminal_Modification Free
C-terminal_Modification Free
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 408.46
Aliphatic_Index 0.00000
Aromaticity 0.66667
Average_Rotatable_Bonds 3.00000
Charge_at_pH_7 -0.00202
Isoelectric_Point 6.10000
Number_of_Hydrogen_Bond_Acceptors 4
Number_of_Hydrogen_Bond_Donors 5
Topological_Polar_Surface_Area 137.31000
X_logP_energy 0.96600
Interaction Information
Affinity IC50=15.11 mM
Affinity_Assay Enzyme Inhibition Kinetics
PDB_ID None
Type Inhibitor
Structure
Reference Information
Document_Type Research Articles
Title Discovery of monoamine oxidase A inhibitory peptides from hairtail (Trichiurus japonicus)using in vitro simulated gastrointestinal digestion and in silico studies.
Release_Year 2020
PMID 32599370
DOI 10.1016/j.bioorg.2020.104032