BIOPEP-UWM: Report

ID 16
Name Antiviral peptide
sequence
QICY

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 525.6180 Monoisotopic mass 525.2249
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])(CCC(=O)N)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CS)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O

InChI=1S/C23H35N5O7S/c1-3-12(2)19(28-20(31)15(24)8-9-18(25)30)22(33)27-17(11-36)21(32)26-16(23(34)35)10-13-4-6-14(29)7-5-13/h4-7,12,15-17,19,29,36H,3,8-11,24H2,1-2H3,(H2,25,30)(H,26,32)(H,27,33)(H,28,31)(H,34,35)/t12-,15-,16-,17-,19-/m0/s1

InChIKey=DXYZTZPBGKRFRF-VWBVUKJASA-N


Bioactivity predicted using molecular docking



Database reference: