BIOPEP-UWM: Report

ID 68
Name Antiviral peptide
sequence
PSY

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7)
 
Number of residues
3
Activity code
avi
Activity :
antiviral
Chemical mass 365.3801 Monoisotopic mass 365.1581
EC50 :
0.00 µM



Bibliographic data:
Authors
Behzadipour Y., Gholampour M., Pirhadi S., Seradj H., Khoshneviszadeh M., Hemmati S.
Title
Viral 3CLpro as a target for antiviral intervention using milk‑derived bioactive peptides. Int. J. Pept. Res. Therapeut., 27, 2703–2716, 2021
Year Source
2021 Journal



Additional information:
BIOPEP-UWM Virtual database


SMILES: SMILES: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CO)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O

InChI=1S/C17H23N3O6/c21-9-14(20-15(23)12-2-1-7-18-12)16(24)19-13(17(25)26)8-10-3-5-11(22)6-4-10/h3-6,12-14,18,21-22H,1-2,7-9H2,(H,19,24)(H,20,23)(H,25,26)/t12-,13-,14-/m0/s1

InChIKey=UGDMQJSXSSZUKL-IHRRRGAJSA-N


Bioactivity predicted using molecular docking


Inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) according to the BIOPEP-UWM database of bioactive peptides (ID 7559)



Database reference:
AHTPDB: ID 1622, 1928, 2691, 4012, 5121, 5864, 6545

BioPepDB: ID biopep01104

BIOPEP-UWM database of bioactive peptides: ID 7559

EROP-Moscow: ID E04101

FeptideDB: ID 7559

PlantPepDB: ID PPepDB_3016

PubChem: CID 145457580

SATPdb: ID satpdb16985