BIOPEP-UWM: Report
| ID | 81 |
| Name | ACE inhibitor |
| sequence |
| Function: | |||
| Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) (PDB ID: 1O86) | |||
| Number of residues | 11 |
Activity code | ah |
| Activity : | ACE inhibitor |
|||
| Chemical mass | 1326.5804 | Monoisotopic mass | 1325.7473 | |
| EC50 : | 0.00 µM |
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| Bibliographic data: | |
| Authors | |
| Marcet I., Delgado J., Díaz N., Rendueles M., Díaz M. | |
| Title | |
| Peptides recovery from egg yolk lipovitellins by ultrafiltration and their in silico bioactivity analysis. Food Chem., 379, 132145, 2022 | |
| Year | Source |
| 2022 | Journal |
| Additional information: |
| BIOPEP-UWM Virtual database SMILES: N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)NCC(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CO)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N[C@@]([H])(CCCCN)C(=O)O InChI=1S/C66H99N15O14/c1-9-36(6)54(78-52(84)33-72-57(85)47(29-39-31-70-43-21-14-12-19-41(39)43)75-58(86)45(25-26-51(68)83)73-62(90)53(69)35(4)5)64(92)80-56(38(8)11-3)65(93)81-28-18-24-50(81)61(89)77-49(34-82)60(88)76-48(30-40-32-71-44-22-15-13-20-42(40)44)59(87)79-55(37(7)10-2)63(91)74-46(66(94)95)23-16-17-27-67/h12-15,19-22,31-32,35-38,45-50,53-56,70-71,82H,9-11,16-18,23-30,33-34,67,69H2,1-8H3,(H2,68,83)(H,72,85)(H,73,90)(H,74,91)(H,75,86)(H,76,88)(H,77,89)(H,78,84)(H,79,87)(H,80,92)(H,94,95)/t36-,37-,38-,45-,46-,47-,48-,49-,50-,53-,54-,55-,56-/m0/s1 InChIKey=KGDHXWDZROSWBP-OTDCKASBSA-N Bioactivity predicted by molecular docking |
| Database reference: |