BIOPEP-UWM: Report
| ID | 107 |
| 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 | 645.7005 | Monoisotopic mass | 645.3322 | |
| 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)N)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C27H47N7O11/c1-3-14(2)22(34-23(40)15(29)7-10-19(30)35)26(43)32-17(9-12-21(38)39)24(41)31-16(8-11-20(36)37)25(42)33-18(27(44)45)6-4-5-13-28/h14-18,22H,3-13,28-29H2,1-2H3,(H2,30,35)(H,31,41)(H,32,43)(H,33,42)(H,34,40)(H,36,37)(H,38,39)(H,44,45)/t14-,15-,16-,17-,18-,22-/m0/s1 InChIKey=ACKJBCSYWIYMAJ-GJYPYGGVSA-N Bioactivity predicted using molecular docking |
| Database reference: |