BIOPEP-UWM: Report

ID 302
Name Pancreatic elastase inhibitor
sequence
GFEWITF
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 898.9974 Monoisotopic mass 898.4211
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: NCC(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@]([H])(CCC(=O)O)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])([C@]([H])(O)C)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)O

InChI=1S/C46H58N8O11/c1-4-26(2)39(44(62)54-40(27(3)55)45(63)52-36(46(64)65)22-29-15-9-6-10-16-29)53-43(61)35(23-30-25-48-32-18-12-11-17-31(30)32)51-41(59)33(19-20-38(57)58)50-42(60)34(49-37(56)24-47)21-28-13-7-5-8-14-28/h5-18,25-27,33-36,39-40,48,55H,4,19-24,47H2,1-3H3,(H,49,56)(H,50,60)(H,51,59)(H,52,63)(H,53,61)(H,54,62)(H,57,58)(H,64,65)/t26-,27+,33-,34-,35-,36-,39-,40-/m0/s1

InChIKey=LJIMWUATTYSBMA-CCRXUVBLSA-N


Bioactivity predicted by molecular docking


Database reference: