BIOPEP-UWM: Report
| ID | 114 |
| 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 | 675.6406 | Monoisotopic mass | 675.2701 | |
| 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)NCC(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CC(=O)O)C(=O)O InChI=1S/C26H41N7O14/c1-11(2)21(25(45)31-14(5-8-19(38)39)23(43)32-15(26(46)47)9-20(40)41)33-24(44)13(4-7-18(36)37)30-17(35)10-29-22(42)12(27)3-6-16(28)34/h11-15,21H,3-10,27H2,1-2H3,(H2,28,34)(H,29,42)(H,30,35)(H,31,45)(H,32,43)(H,33,44)(H,36,37)(H,38,39)(H,40,41)(H,46,47)/t12-,13-,14-,15-,21-/m0/s1 InChIKey=NQRZCYJQUCAVFU-ZXJNPZNQSA-N Bioactivity predicted using molecular docking |
| Database reference: |