BIOPEP-UWM: Report

ID 72
Name Antiviral peptide
sequence
RNA

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 359.3805 Monoisotopic mass 359.1912
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: N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(C)C(=O)O

InChI=1S/C13H25N7O5/c1-6(12(24)25)19-11(23)8(5-9(15)21)20-10(22)7(14)3-2-4-18-13(16)17/h6-8H,2-5,14H2,1H3,(H2,15,21)(H,19,23)(H,20,22)(H,24,25)(H4,16,17,18)/t6-,7-,8-/m0/s1

InChIKey=DCGLNNVKIZXQOJ-FXQIFTODSA-N


Bioactivity predicted using molecular docking



Database reference:
ChEBI: ID 158761

ChemSpider: ID 57478643

PubChem: CID 91974549