BIOPEP-UWM: Report

ID 435
Name Dipeptidyl peptidase IV inhibitor
sequence
YLEELHRLN
Function:
Predicted inhibitor of Dipeptidyl peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) (PDB ID: 4A5S)
 
Number of residues
9
Activity code
dpp
Activity :
dipeptidyl peptidase IV inhibitor
Chemical mass 1186.3137 Monoisotopic mass 1185.6123
EC50 :
0.00 µM


Bibliographic data:
Authors
Mudgil P., Gan C.-Y., Yap P.-G., Redha A. A., Reem H., Alsaadi S., Mohteshamuddin K., Aguilar-Toalá J. E., Vidal-Limon A. M., Liceaga A. M., Maqsood S.
Title
Exploring the dipeptidyl peptidase IV inhibitory potential of probiotic-fermented milk: An in vitro and in silico comprehensive investigation into peptides from milk of different farm animals. J. Dairy Sci., 107, 10153-10173, 2024
Year Source
2024 Journal


Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@H](CC1=CN=C[NH]1)C(=O)N[C@@]([H])(CCCNC(=N)N)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CC(=O)N)C(=O)O

InChI=1S/C53H83N15O16/c1-26(2)18-36(64-44(75)32(54)21-29-9-11-31(69)12-10-29)48(79)63-34(13-15-42(71)72)46(77)62-35(14-16-43(73)74)47(78)66-37(19-27(3)4)49(80)67-39(22-30-24-58-25-60-30)51(82)61-33(8-7-17-59-53(56)57)45(76)65-38(20-28(5)6)50(81)68-40(52(83)84)23-41(55)70/h9-12,24-28,32-40,69H,7-8,13-23,54H2,1-6H3,(H2,55,70)(H,58,60)(H,61,82)(H,62,77)(H,63,79)(H,64,75)(H,65,76)(H,66,78)(H,67,80)(H,68,81)(H,71,72)(H,73,74)(H,83,84)(H4,56,57,59)/t32-,33-,34-,35-,36-,37-,38-,39-,40-/m0/s1

InChIKey=OHVVOQIVGHQLKS-LCQMPJFHSA-N


Bioactivity predicted by molecular docking


Database reference: