BIOPEP-UWM: Report

ID 298
Name Pancreatic elastase inhibitor
sequence
DQNPRSF
Function:
Predicted inhibitor of Pancreatic elastase (EC 3.4.21.36) (MEROPS ID: S01.153) (PDB ID: 1LVY)
 
Number of residues
7
Activity code
pel
Activity :
pancreatic elastase inhibitor
Chemical mass 862.8844 Monoisotopic mass 862.3921
EC50 :
0.00 µM


Bibliographic data:
Authors
Aguilar-Toalá J.E., Liceaga A.M.
Title
Identification of chia seed (Salvia hispanica L.) peptides with enzyme inhibition activity towards skin-aging enzymes. Amino Acids, 52(8), 1149-1159, 2020
Year Source
2020 Journal


Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(CC(=O)O)C(=O)N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])(CO)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)O


InChI=1S/C36H54N12O13/c37-19(15-28(52)53)29(54)43-21(10-11-26(38)50)31(56)45-22(16-27(39)51)34(59)48-13-5-9-25(48)33(58)44-20(8-4-12-42-36(40)41)30(55)47-24(17-49)32(57)46-23(35(60)61)14-18-6-2-1-3-7-18/h1-3,6-7,19-25,49H,4-5,8-17,37H2,(H2,38,50)(H2,39,51)(H,43,54)(H,44,58)(H,45,56)(H,46,57)(H,47,55)(H,52,53)(H,60,61)(H4,40,41,42)/t19-,20-,21-,22-,23-,24-,25-/m0/s1

InChIKey=PUTRVBAVWXNZBF-HUVRVWIJSA-N


Bioactivity predicted by molecular docking


Database reference: