BIOPEP-UWM: Report

ID 253
Name Predicted antioxidative peptide
sequence
NANSLAGPQR
Function:
Predicted ligand of murine Keap1 (PDB ID: 5CGJ)
 
Number of residues
10
Activity code
ao
Activity :
antioxidative
Chemical mass 1027.0899 Monoisotopic mass 1026.5191
EC50 :
0.00 µM


Bibliographic data:
Authors
Ong J.-H., Koh J.-A., Cao H., Tan S.-A., Manan F. A., Wong F.-C., Chai T. -T.
Title
Purification, identification and characterization of antioxidant peptides from corn silk tryptic hydrolysate: an integrated in vitro-in silico approach. Antioxidants, 10, 1822, 2021
Year Source
2021 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(C)C(=O)NCC(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)O

InChI=1S/C41H70N16O15/c1-18(2)13-24(55-38(69)26(17-58)56-37(68)25(15-30(45)61)54-33(64)20(4)50-34(65)21(42)14-29(44)60)36(67)51-19(3)32(63)49-16-31(62)57-12-6-8-27(57)39(70)52-22(9-10-28(43)59)35(66)53-23(40(71)72)7-5-11-48-41(46)47/h18-27,58H,5-17,42H2,1-4H3,(H2,43,59)(H2,44,60)(H2,45,61)(H,49,63)(H,50,65)(H,51,67)(H,52,70)(H,53,66)(H,54,64)(H,55,69)(H,56,68)(H,71,72)(H4,46,47,48)/t19-,20-,21-,22-,23-,24-,25-,26-,27-/m0/s1

InChIKey= KDDVNOYHSAMXBI-JOXZBDCSSA-N

Preliminary predictions were done using QSAR (program AnOxPePred). Interactions between peptide and receptors were predicted using molecular docking.


Database reference: