BIOPEP-UWM: Report

ID 161
Name Antiviral peptide
sequence
YVSSYYHT

Function:
Predicted ligand of SARS-CoV-2 main protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB: 6M03), papain-like protease (EC 3.4.19.12) (MEROPS ID: C16.009) (PDB: 6W9C) and spike glycoprotein (PDB: 6LZG)
 
Number of residues
8
Activity code
avi
Activity :
antiviral
Chemical mass 1019.0614 Monoisotopic mass 1018.4381
EC50 :
0.00 µM



Bibliographic data:
Authors
Ong J.-H., Liang C.-E., Wong W.-L., Wong F.-C., Chai T.-T.
Title
Multi-target anti-SARS-Cov-2 peptides from mealworm proteins: an in silico study. Malaysian J. Biochem. Mol. Biol., 1, 83-91, 2021
Year Source
2021 Journal



Additional information:
BIOPEP-UWM Virtual database


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

InChI=1S/C48H62N10O15/c1-24(2)39(57-41(65)33(49)16-26-4-10-30(62)11-5-26)47(71)56-38(22-60)46(70)55-37(21-59)45(69)53-35(18-28-8-14-32(64)15-9-28)42(66)52-34(17-27-6-12-31(63)13-7-27)43(67)54-36(19-29-20-50-23-51-29)44(68)58-40(25(3)61)48(72)73/h4-15,20,23-25,33-40,59-64H,16-19,21-22,49H2,1-3H3,(H,50,51)(H,52,66)(H,53,69)(H,54,67)(H,55,70)(H,56,71)(H,57,65)(H,58,68)(H,72,73)/t25-,33+,34+,35+,36+,37+,38+,39+,40+/m1/s1

InChIKey=CACHOEGAYOHVSR-IEYQDEGESA-N


Bioactivity predicted using molecular docking



Database reference: