BIOPEP-UWM: Report
| ID | 119 |
| 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 | 564.5421 | Monoisotopic mass | 564.2382 | |
| 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])(C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CO)C(=O)O InChI=1S/C21H36N6O12/c1-8(16(33)26-13(7-29)21(38)39)24-19(36)12(6-28)25-20(37)15(10(3)30)27-17(34)9(2)23-18(35)11(22)4-5-14(31)32/h8-13,15,28-30H,4-7,22H2,1-3H3,(H,23,35)(H,24,36)(H,25,37)(H,26,33)(H,27,34)(H,31,32)(H,38,39)/t8-,9-,10+,11-,12-,13-,15-/m0/s1 InChIKey=BCVNYVDVHLIZQY-SFXPETSLSA-N Bioactivity predicted using molecular docking |
| Database reference: |