BIOPEP-UWM: Report

ID 22
Name Antiviral peptide
sequence
ICIY

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB: 6LU7)
 
Number of residues
4
Activity code
avi
Activity :
antiviral
Chemical mass 510.6463 Monoisotopic mass 510.2503
EC50 :
0.00 µM



Bibliographic data:
Authors
Yao Y., Luo Z., Zhang X.
Title
In silico evaluation of marine fish proteins as nutritional supplement for COVID-2019 patients. Food Funct., 11, 5565-5572, 2020
Year Source
2020 Journal



Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CS)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O

InChI=1S/C24H38N4O6S/c1-5-13(3)19(25)22(31)27-18(12-35)21(30)28-20(14(4)6-2)23(32)26-17(24(33)34)11-15-7-9-16(29)10-8-15/h7-10,13-14,17-20,29,35H,5-6,11-12,25H2,1-4H3,(H,26,32)(H,27,31)(H,28,30)(H,33,34)/t13-,14-,17-,18-,19-,20-/m0/s1

InChIKey=BVUAROWEYNYQHH-LMYCGTSZSA-N


Bioactivity predicted using molecular docking



Database reference: