BIOPEP-UWM: Report
| ID | 91 |
| 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 | 7 |
Activity code | avi |
| Activity : | antiviral |
|||
| Chemical mass | 861.8484 | Monoisotopic mass | 861.3702 | |
| 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)O)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C34H55N9O17/c1-16(28(53)43-22(34(59)60)4-2-3-15-35)38-30(55)19(7-12-25(47)48)41-31(56)18(6-10-23(37)44)40-33(58)21(9-14-27(51)52)42-32(57)20(8-13-26(49)50)39-29(54)17(36)5-11-24(45)46/h16-22H,2-15,35-36H2,1H3,(H2,37,44)(H,38,55)(H,39,54)(H,40,58)(H,41,56)(H,42,57)(H,43,53)(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,59,60)/t16-,17-,18-,19-,20-,21-,22-/m0/s1 InChIKey=FDTXTSRWVZWZAG-CPDXTSBQSA-N Bioactivity predicted using molecular docking |
| Database reference: |