BIOPEP-UWM: Report

ID 67
Name Antiviral peptide
sequence
PQY
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 406.4319 Monoisotopic mass 406.1846
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: N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O

InChI=1S/C19H26N4O6/c20-16(25)8-7-14(22-17(26)13-2-1-9-21-13)18(27)23-15(19(28)29)10-11-3-5-12(24)6-4-11/h3-6,13-15,21,24H,1-2,7-10H2,(H2,20,25)(H,22,26)(H,23,27)(H,28,29)/t13-,14-,15-/m0/s1

InChIKey=KTFZQPLSPLWLKN-KKUMJFAQSA-N


Bioactivity predicted using molecular docking


Database reference:
ChEBI: ID 162255

PubChem: CID 145457454