BIOPEP-UWM: Report
| ID | 115 |
| 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 | 4 |
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])(CCC(=O)N)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C22H40N6O8/c1-3-12(2)18(21(34)27-15(22(35)36)6-4-5-11-23)28-20(33)14(8-9-16(25)29)26-19(32)13(24)7-10-17(30)31/h12-15,18H,3-11,23-24H2,1-2H3,(H2,25,29)(H,26,32)(H,27,34)(H,28,33)(H,30,31)(H,35,36)/t12-,13-,14-,15-,18-/m0/s1 InChIKey=PBVQZZXOPVXRLD-PQKJENKHSA-N Bioactivity predicted using molecular docking |
| Database reference: |