BIOPEP-UWM: Report

ID 87
Name bitter peptide
sequence
KPFE
Function:
Predicted ligand of hTAS2R1 bitter taste receptor
 
Number of residues
4
Activity code
bi
Activity :
bitter taste peptide
Chemical mass 519.5891 Monoisotopic mass 519.2684
EC50 :
0.00 µM


Bibliographic data:
Authors
Wang F., Yang W., Zhou B.
Title
Molecular-level understanding of the hTAS2R1 receptor-bitter tasting tetra-peptide binding: a structural biology study based on computational approaches. New J. Chem., 45, 21369-21381, 2021
Year Source
2021 Journal


Additional information:
BIOPEP-UWM database of sensory peptides and amino acids


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

InChI=1S/C25H37N5O7/c26-13-5-4-9-17(27)24(35)30-14-6-10-20(30)23(34)29-19(15-16-7-2-1-3-8-16)22(33)28-18(25(36)37)11-12-21(31)32/h1-3,7-8,17-20H,4-6,9-15,26-27H2,(H,28,33)(H,29,34)(H,31,32)(H,36,37)/t17-,18-,19-,20-/m0/s1

InChIKey=LTPIJJDCUGOUSN-MUGJNUQGSA-N


Activity predicted using 3D QSAR


Database reference: