BIOPEP-UWM: Report
| ID | 102 |
| Name | Antiviral peptide |
| sequence |
| Function: | |||
| Predicted ligand of SARS-CoV-2 parent protease (EC 3.4.22.69) (MEROPS ID: C30.007) (PDB ID: 6LU7) | |||
| Number of residues | 6 |
Activity code | avi |
| Activity : | antiviral |
|||
| Chemical mass | 677.6135 | Monoisotopic mass | 677.2494 | |
| EC50 : | 0.00 µM |
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| Bibliographic data: | |
| Authors | |
| Yu Z., Kan R., Ji H., Wu S., Zhao W., Shuian D., Liu J., Li J. | |
| Title | |
| Identification of tuna protein-derived peptides as potent SARS-CoV-2 inhibitors via molecular docking and molecular dynamic simulation. Food Chem., 342, 128366, 2021 | |
| Year | Source |
| 2021 | Journal |
| Additional information: |
| BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)NCC(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)O InChI=1S/C25H39N7O15/c26-11(1-6-18(36)37)21(42)30-12(3-7-19(38)39)22(43)28-9-17(35)29-13(2-5-16(27)34)23(44)32-15(10-33)24(45)31-14(25(46)47)4-8-20(40)41/h11-15,33H,1-10,26H2,(H2,27,34)(H,28,43)(H,29,35)(H,30,42)(H,31,45)(H,32,44)(H,36,37)(H,38,39)(H,40,41)(H,46,47)/t11-,12-,13-,14-,15-/m0/s1 InChIKey=FRECFFZVURSWIT-YTFOTSKYSA-N Bioactivity predicted using molecular docking |
| Database reference: |