Molecular mechanics analysis of inhibitor binding to HIV-1 protease

Protein Engineering, Design and Selection

Volumn 5, Issue 7, 1992, Pages 659-667

  Sansom, Clare E ^a,b,c   Wu, Jin ^a   Weber, Irene T ^a  

^a THOMAS JEFFERSON UNIVERSITY HOSPITAL   (United States)

^b NATIONAL CANCER INSTITUTE   (United States)

^c UNIVERSITY OF LEEDS   (United Kingdom)

Author keywords

Aspartic proteases; HIV 1; Inhibitor binding; Molecular mechanics

Indexed keywords

ASPARTIC ACID; ASPARTIC PROTEINASE; HYDROXYL GROUP; PROTEINASE; PROTEINASE INHIBITOR; VIRUS ENZYME;

ARTICLE; DIELECTRIC CONSTANT; ENERGY; ENZYME ACTIVE SITE; ENZYME BINDING; ENZYME INHIBITOR COMPLEX; ENZYME STRUCTURE; ENZYME SUBUNIT; HUMAN IMMUNODEFICIENCY VIRUS 1; HYDROGEN BOND; HYDROPHOBICITY; MOLECULAR INTERACTION; NONHUMAN; X RAY CRYSTALLOGRAPHY;

AMINO ACID SEQUENCE; BINDING SITES; COMPUTER SIMULATION; DATABASES, FACTUAL; HIV PROTEASE; HIV PROTEASE INHIBITORS; HYDROGEN BONDING; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR SEQUENCE DATA; PROTEIN CONFORMATION; SOFTWARE; SOLVENTS; SUPPORT, U.S. GOV'T, P.H.S.; X-RAY DIFFRACTION;

EID: 0026438932     PISSN: 17410126     EISSN: None     Source Type: Journal    
DOI: 10.1093/protein/5.7.659     Document Type: Article

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