BIOPEP-UWM: Report

ID 9060
Name ACE inhibitor
sequence
AVL

Function:
Inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001)
 
Number of residues
3
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 301.3808 Monoisotopic mass 301.1995
IC50 :
7.11 µM



Bibliographic data:
Authors
Matsui T., Yukiyoshi A., Doi S., Sugimoto H., Yamada H., Matsumoto K.
Title
Gastrointestinal enzyme production of bioactive peptides from royal jelly protein and their antihypertensive ability in SHR. J. Nutr. Biochem., 13, 80-86, 2002
Year Source
2002 Journal



Additional information:
BIOPEP-UWM database of bioactive peptides


SMILES: N[C@@]([H])(C)C(=O)N[C@@]([H])(C(C)C)C(=O)N[C@@]([H])(CC(C)C)C(=O)O

InChI=1S/C14H27N3O4/c1-7(2)6-10(14(20)21)16-13(19)11(8(3)4)17-12(18)9(5)15/h7-11H,6,15H2,1-5H3,(H,16,19)(H,17,18)(H,20,21)/t9-,10-,11-/m0/s1

InChIKey=RFJNDTQGEJRBHO-DCAQKATOSA-N


Information concerning Angiotensin-Converting Enzyme (ACE) is available in MEROPS database of proteolytic enzymes (http://merops.sanger.ac.uk/); ID: M02-001


Predicted ligand of calpain 1 (EC 3.4.22.52) (MEROPS ID: C02.001) (AlphaFold ID: AF-P07384-F1) according to the BIOPEP-UWM Virtual database (ID 266)
Predicted ligand of ubiquitin ligase (XIAP) (EC 2.3.2.27) (Alpha Fold ID AF-P98170-F1-model-v2) according to the BIOPEP-UWM Virtual database (ID 279)
Predicted ligand of cyclooxygenase-2 (COX-2) (EC 1.14.99.1) (PDB ID: 5K1R) according to the BIOPEP-UWM Virtual database: (ID 285)
Predicted inhibitor of Dipeptidyl peptidase IV (EC 3.4.14.5) (MEROPS ID: S09.003) (PDB ID: 3Q8W) according to the BIOPEP-UWM Virtual database: (ID 288)



Database reference:
AHTPDB: ID 1620, 2681

BindingDB: ID 50350463

BioPepDB: ID biopep00085

BIOPEP-UWM Virtual database: ID 266; 279; 285; 288

CAS: Registry No 93414-38-1

ChEBI: ID 158661

ChEMBL: ID CHEMBL1814489

ChemSpider: ID 5384361

DFBP: ID DFBPANHY0635

EROP-Moscow: ID E06686

J-GLOBAL: ID 200907067216016588

Metabolomics Workbench: ID 79446

Nikkaji: ID J1.717.209C

PubChem: CID 7021452

SATPdb: ID satpdb23086

ZINC: ID ZINC000002572102