BIOPEP-UWM: Report
| ID | 103 |
| 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 | 661.6999 | Monoisotopic mass | 661.3271 | |
| 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])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(C)C(=O)O InChI=1S/C27H47N7O12/c1-6-11(2)20(33-22(40)16(8-10-18(38)39)31-24(42)19(29)13(4)35)25(43)32-15(7-9-17(28)37)23(41)34-21(14(5)36)26(44)30-12(3)27(45)46/h11-16,19-21,35-36H,6-10,29H2,1-5H3,(H2,28,37)(H,30,44)(H,31,42)(H,32,43)(H,33,40)(H,34,41)(H,38,39)(H,45,46)/t11-,12-,13+,14+,15-,16-,19-,20-,21-/m0/s1 InChIKey=OFWQOGATSLAASV-WMRCVUJESA-N Bioactivity predicted using molecular docking |
| Database reference: |