Fragment-based design for the development of n-domain-selective angiotensin-1-converting enzyme inhibitors

Clinical Science

Volumn 126, Issue 4, 2014, Pages 305-313

  Douglas, Ross G ^a   Sharma, Rajni K ^a   Masuyer, Geoffrey ^a   Lubbe, Lizelle ^a   Zamora, Ismael ^c   Acharya, K Ravi ^b   Chibale, Kelly ^a   Sturrock, Edward D ^a  

^a UNIVERSITY OF CAPE TOWN   (South Africa)

^b University of Bath   (United Kingdom)

^c UNIVERSITAT POMPEU FABRA   (Spain)

Author keywords

Angiotensin 1 converting enzyme (ACE); Crystal structure; In silico screening; Inhibitor design; Kinetics; Rxp407

Indexed keywords

1X 0802; 2B 004; 33RE; AF 399; BTB 08399; CA 4124; CAPTOPRIL; DIPEPTIDYL CARBOXYPEPTIDASE; DIPEPTIDYL CARBOXYPEPTIDASE INHIBITOR; ENALAPRILAT; HC 6004; HYDROXYL GROUP; JCC 0014; LISINOPRIL; RAMIPRILAT; RXP 407; UNCLASSIFIED DRUG;

ARTICLE; CRYSTAL STRUCTURE; FIBROSIS; HUMAN; HYDROGEN BOND; PRIORITY JOURNAL; PROTEIN PURIFICATION; TISSUE INJURY; X RAY CRYSTALLOGRAPHY;

ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; BINDING SITES; BLOOD PRESSURE; DRUG DESIGN; OLIGOPEPTIDES; PEPTIDYL-DIPEPTIDASE A; PHOSPHINIC ACIDS; PROTEIN CONFORMATION;

EID: 84886673811     PISSN: 01435221     EISSN: None     Source Type: Journal    
DOI: 10.1042/CS20130403     Document Type: Article

References (4)

1. Bergmann, R., Liljefors, T., Sorensen, M. D. and Zamora, I. (2009) SHOP: receptor-based scaffold HOPping by GRID-based similarity searches. J. Chem. Inf. Model 49, 658-669
2. Anthony, C. S., Corradi, H. R., Schwager, S. L., Redelinghuys, P., Georgiadis, D., Dive, V., Acharya, K. R. and Sturrock, E. D. (2010) The N domain of human angiotensin-I-converting enzyme: the role of N-glycosylation and the crystal structure in complex with an N domain-specific phosphinic inhibitor, RXP407. J. Biol. Chem. 285, 35685-35693
3. Kroger, W. L., Douglas, R. G., O'Neill, H. G., Dive, V. and Sturrock, E. D. (2009) Investigating the domain specificity of phosphinic inhibitors RXPA380 and RXP407 in angiotensin-converting enzyme. Biochemistry 48, 8405-8412
4. Wei, L., Alhenc-Gelas, F., Corvol, P. and Clauser, E. (1991) The two homologous domains of human angiotensin I-converting enzyme are both catalytically active. J. Biol. Chem. 266, 9002-9008