BIOPEP-UWM: Report

ID 352
Name Pancreatic lipase inhibitor
sequence
APSFSDIPNPIGSENSEKTTMPLW
Function:
Predicted inhibitor of pancreatic lipase (EC 3.4.23.1) (PDB ID: 1ETH)
 
Number of residues
24
Activity code
plip
Activity :
pancreatic lipase inhibitor
Chemical mass 2618.8619 Monoisotopic mass 2617.2328
EC50 :
0.00 µM


Bibliographic data:
Authors
Mudgil P., Ajayi F. F., Alyafei A. S., Yap P.-G., Gan C.-Y., Maqsood S.
Title
Unlocking the hypolipidemic potential of bioactive peptides derived from probiotic fermented cattle, camel, goat, and sheep milk: a comprehensive investigation through in vitro, in silico, and molecular docking studies. Front. Sustain. Food Syst., 8, 1443708, 2024
Year Source
2024 Journal


Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@]([H])(C)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CO)C(=O)N[C@@H](CC1=CC=C(C=C1))C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CC(=O)O)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])([C@]([H])(CC)C)C(=O)NCC(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CC(=O)N)C(=O)N[C@@]([H])(CO)C(=O)N[C@@]([H])(CCC(=O)O)C(=O)N[C@@]([H])(CCCCN)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])([C@]([H])(O)C)C(=O)N[C@@]([H])(CCSC)C(=O)N1[C@@]([H])(CCC1)C(=O)N[C@@]([H])(CC(C)C)C(=O)N[C@@H](CC1=C[NH]C2=CC=CC=C12)C(=O)O

InChI=1S/C116H176N28O39S/c1-11-57(5)90(137-108(174)83-32-22-41-143(83)114(180)74(48-85(120)152)132-106(172)82-31-23-42-144(82)115(181)91(58(6)12-2)138-100(166)73(49-89(158)159)130-103(169)78(54-147)134-98(164)71(45-62-24-14-13-15-25-62)128-104(170)79(55-148)136-107(173)80-29-20-39-141(80)112(178)59(7)118)109(175)122-51-86(153)123-76(52-145)101(167)125-68(34-36-88(156)157)95(161)129-72(47-84(119)151)99(165)135-77(53-146)102(168)126-67(33-35-87(154)155)94(160)124-66(28-18-19-38-117)96(162)139-93(61(9)150)111(177)140-92(60(8)149)110(176)127-69(37-43-184-10)113(179)142-40-21-30-81(142)105(171)131-70(44-56(3)4)97(163)133-75(116(182)183)46-63-50-121-65-27-17-16-26-64(63)65/h13-17,24-27,50,56-61,66-83,90-93,121,145-150H,11-12,18-23,28-49,51-55,117-118H2,1-10H3,(H2,119,151)(H2,120,152)(H,122,175)(H,123,153)(H,124,160)(H,125,167)(H,126,168)(H,127,176)(H,128,170)(H,129,161)(H,130,169)(H,131,171)(H,132,172)(H,133,163)(H,134,164)(H,135,165)(H,136,173)(H,137,174)(H,138,166)(H,139,162)(H,140,177)(H,154,155)(H,156,157)(H,158,159)(H,182,183)/t57-,58-,59-,60+,61+,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,90-,91-,92-,93-/m0/s1

InChIKey=HKHUQFILCQGCKF-BPDXZUPMSA-N


Activity predicted using molecular docking.


Database reference: