BIOPEP-UWM: Report

ID 75
Name Antiviral peptide
sequence
PHYNN

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7), spike glycoprotein RBD (PDB ID: 6LZG) and papain-like protein (EC 3.4.19.12) (MEROPS ID: C16.009) (PDB ID: 6WX4)
 
Number of residues
5
Activity code
avi
Activity :
antiviral
Chemical mass 643.6468 Monoisotopic mass 643.2706
EC50 :
0.00 µM



Bibliographic data:
Authors
Wong F.-C., Ong J.-H., Kumar D. T., Chai T.-T.
Title
In silico identification of multi‑target anti‑SARS‑CoV‑2 peptides from quinoa seed proteins. Int. J. Peptide Res. Therapeut., 27, 1837–1847, 2021
Year Source
2021 Journal



Additional information:
BIOPEP-UWM Virtual database


SMILES: N1[C@@]([H])(CCC1)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CC(=O)N)C(=O)O

InChI=1S/C28H37N9O9/c29-22(39)10-20(27(44)37-21(28(45)46)11-23(30)40)36-25(42)18(8-14-3-5-16(38)6-4-14)34-26(43)19(9-15-12-31-13-33-15)35-24(41)17-2-1-7-32-17/h3-6,12-13,17-21,32,38H,1-2,7-11H2,(H2,29,39)(H2,30,40)(H,31,33)(H,34,43)(H,35,41)(H,36,42)(H,37,44)(H,45,46)/t17-,18-,19-,20-,21-/m0/s1

InChIKey=DBYYWAWHXKLZHL-SXYSDOLCSA-N


Bioactivity predicted using molecular docking




Database reference: