BIOPEP-UWM: Report
| ID | 97 |
| 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 | 630.6892 | Monoisotopic mass | 630.3326 | |
| 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])(CC)C)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)O InChI=1S/C26H46N8O10/c1-5-13(4)19(27)23(41)33-16(11-18(37)38)22(40)34-20(12(2)3)24(42)31-14(8-9-17(35)36)21(39)32-15(25(43)44)7-6-10-30-26(28)29/h12-16,19-20H,5-11,27H2,1-4H3,(H,31,42)(H,32,39)(H,33,41)(H,34,40)(H,35,36)(H,37,38)(H,43,44)(H4,28,29,30)/t13-,14-,15-,16-,19-,20-/m0/s1 InChIKey=NASYJTZSDYVPRC-IGVQRDAMSA-N Bioactivity predicted using molecular docking |
| Database reference: |