BIOPEP-UWM: Report

ID 19
Name Antiviral peptide
sequence
ITTIM

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB: 6LU7)
 
Number of residues
5
Activity code
avi
Activity :
antiviral
Chemical mass 577.7336 Monoisotopic mass 577.3134
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])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCSC)C(=O)O

InChI=1S/C25H47N5O8S/c1-8-12(3)17(26)21(33)29-19(14(5)31)24(36)30-20(15(6)32)23(35)28-18(13(4)9-2)22(34)27-16(25(37)38)10-11-39-7/h12-20,31-32H,8-11,26H2,1-7H3,(H,27,34)(H,28,35)(H,29,33)(H,30,36)(H,37,38)/t12-,13-,14+,15+,16-,17-,18-,19-,20-/m0/s1

InChIKey=WBJCCGRSJZUFEO-NFZMNTBDSA-N


Bioactivity predicted using molecular docking



Database reference: