BIOPEP-UWM: Report
| ID | 98 |
| 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 | 759.8425 | Monoisotopic mass | 759.4000 | |
| EC50 : | 0.00 µM |
|||
| 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])(CC)C)C(=O)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])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C33H57N7O13/c1-5-17(3)26(35)31(50)38-20(11-14-24(43)44)29(48)36-19(10-13-23(41)42)28(47)37-21(12-15-25(45)46)30(49)40-27(18(4)6-2)32(51)39-22(33(52)53)9-7-8-16-34/h17-22,26-27H,5-16,34-35H2,1-4H3,(H,36,48)(H,37,47)(H,38,50)(H,39,51)(H,40,49)(H,41,42)(H,43,44)(H,45,46)(H,52,53)/t17-,18-,19-,20-,21-,22-,26-,27-/m0/s1 InChIKey=ZJZDLZQGMPJWSR-WGDHFLKDSA-N Bioactivity predicted using molecular docking |
| Database reference: |