BIOPEP-UWM: Report

ID 12
Name DPPIV inhibitor
sequence
QADPKTFYGLM
Function:
Predicted inhibitor of Dipeptidyl peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) (PDB ID: 1PFQ)
 
Number of residues
11
Activity code
dpp
Activity :
dipeptidyl peptidase IV inhibitor
Chemical mass 1270.4509 Monoisotopic mass 1269.6043
EC50 :
0.00 µM


Bibliographic data:
Authors
Garzón A. G., Veras F. F., Brandelli A., Drago S. R.
Title
Purification, identification and in silico studies of antioxidant, antidiabetogenic and antibacterial peptides obtained from sorghum spent grain hydrolysate. LWT, 153, 112414, 2022
Year Source
2022 Journal


Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(CCC(=O)N)C(=O)N[C@@]([H])(C)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCC(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCSC)C(=O)O

InChI=1S/C58H87N13O17S/c1-31(2)26-40(53(82)66-39(58(87)88)22-25-89-5)64-46(75)30-62-51(80)41(28-35-16-18-36(73)19-17-35)67-54(83)42(27-34-12-7-6-8-13-34)68-56(85)48(33(4)72)70-52(81)38(14-9-10-23-59)65-55(84)44-15-11-24-71(44)57(86)43(29-47(76)77)69-49(78)32(3)63-50(79)37(60)20-21-45(61)74/h6-8,12-13,16-19,31-33,37-44,48,72-73H,9-11,14-15,20-30,59-60H2,1-5H3,(H2,61,74)(H,62,80)(H,63,79)(H,64,75)(H,65,84)(H,66,82)(H,67,83)(H,68,85)(H,69,78)(H,70,81)(H,76,77)(H,87,88)/t32-,33+,37-,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1

InChIKey=FECWYOLDHDGRDU-UTSVTYMMSA-N


Bioactivity predicted using molecular docking


Database reference: