BIOPEP-UWM: Report
| ID | 110 |
| 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 | 5 |
Activity code | avi |
| Activity : | antiviral |
|||
| Chemical mass | 516.5868 | Monoisotopic mass | 516.2898 | |
| 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(C)C)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C22H40N6O8/c1-11(2)17(28-19(32)13(4)25-20(33)14(24)8-9-16(29)30)21(34)26-12(3)18(31)27-15(22(35)36)7-5-6-10-23/h11-15,17H,5-10,23-24H2,1-4H3,(H,25,33)(H,26,34)(H,27,31)(H,28,32)(H,29,30)(H,35,36)/t12-,13-,14-,15-,17-/m0/s1 InChIKey=AQMASAWYPOSIID-BWJWTDLKSA-N Bioactivity predicted using molecular docking |
| Database reference: |