PPIRE07783

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 LPNSLYQQ
Peptide_Sequence LPNSLYQQ
Peptide_Length 8
Peptide_SMILES CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)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 962.07
Aliphatic_Index 97.50000
Aromaticity 0.12500
Average_Rotatable_Bonds 3.62500
Charge_at_pH_7 -0.00287
Isoelectric_Point 6.09320
Hydrogen_Bond_Acceptors 14
Hydrogen_Bond_Donors 13
Topological_Polar_Surface_Area 427.96000
X_logP_energy -4.26270
Interaction Information
Affinity IC50=1.981 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