BIOPEP-UWM: Report

ID 48
Name Antiviral peptide
sequence
KC

Function:
Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7)
 
Number of residues
2
Activity code
avi
Activity :
antiviral
Chemical mass 249.3308 Monoisotopic mass 249.1143
EC50 :
0.00 µM



Bibliographic data:
Authors
Zhao W., Li W., Yu Z., Wu S., Ding L., Liu J.
Title
Identification of lactoferrin-derived peptides as potential inhibitors against the main protease of SARS-CoV-2. LWT, 154, 112684, 2022
Year Source
2022 Journal



Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])(CS)C(=O)O

InChI=1S/C9H19N3O3S/c10-4-2-1-3-6(11)8(13)12-7(5-16)9(14)15/h6-7,16H,1-5,10-11H2,(H,12,13)(H,14,15)/t6-,7-/m0/s1

InChIKey=QBGPXOGXCVKULO-BQBZGAKWSA-N


Bioactivity predicted using molecular docking



Database reference:
Database reference:

ChEBI: ID 157871

ChemIDplus: ID 106325-92-2; Substance Lysylcysteine

ChemSpider: ID 32700030

EPA CompTox: ID DTXSID70147577

FDA SRS: ID K0XE496L98; Substance Lysylcysteine

FooDB: ID FDB111971

HMDB: ID HMDB0028948

J-GLOBAL: ID 201007097813116949

Nikkaji: ID J2.836.040A

PubChem: CID 71816170

SureChEMBL: ID SCHEMBL14957758

UNII: ID K0XE496L98