BIOPEP-UWM: Report
| ID | 125 |
| 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 | 589.5912 | Monoisotopic mass | 589.2585 | |
| 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)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)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)O InChI=1S/C24H39N5O12/c1-4-11(2)19(29-22(38)14(6-9-17(32)33)26-20(36)12(3)25)23(39)27-13(5-8-16(30)31)21(37)28-15(24(40)41)7-10-18(34)35/h11-15,19H,4-10,25H2,1-3H3,(H,26,36)(H,27,39)(H,28,37)(H,29,38)(H,30,31)(H,32,33)(H,34,35)(H,40,41)/t11-,12-,13-,14-,15-,19-/m0/s1 InChIKey=IKEJXLSAMQXZPK-XPIIOQNOSA-N Bioactivity predicted using molecular docking |
| Database reference: |