Outside-binding site mutations modify the active site's shapes in neuraminidase from influenza A H1N1

Biopolymers

Volumn 99, Issue 1, 2013, Pages 10-21

  Tolentino Lopez, Luis ^a   Segura Cabrera, Aldo ^b   Reyes Loyola, Paola ^a   Zimic, Mirko ^c,d   Quiliano, Miguel ^c,d   Briz, Veronica ^e   Muñoz Fernández, Angeles ^e   Rodríguez Pérez, Mario ^b   Ilizaliturri Flores, Ian ^a   Correa Basurto, Jose ^a  

^a Seccioacute n de Estudios de Posgrado e Investigacioacute n   (Mexico)

^b INSTITUTO POLITÉCNICO NACIONAL   (Mexico)

^c UNIVERSIDAD PERUANA CAYETANO HEREDIA   (Peru)

^d UNIVERSITY OF NAVARRA   (Spain)

^e HOSPITAL GENERAL UNIVERSITARIO GREGORIO MARAÑÓN   (Spain)

Author keywords

docking; molecular dynamics; neuraminidase

Indexed keywords

ACTIVE SITE; BINDING MODES; COMPARATIVE ANALYSIS; ENERGY VALUE; HOMOLOGY MODELING; INFLUENZA A; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; NA SEQUENCES; NEURAMINIDASE; NEW SOURCES; OSELTAMIVIR; REFINED MODEL; STRUCTURAL MEASURES; STRUCTURAL VARIATIONS; TAMIFLU; THREE DIMENSIONAL (3D) STRUCTURES; VISUAL INSPECTION; WILD TYPES;

BINDING ENERGY; DOCKING; DRUG THERAPY; ENERGY MANAGEMENT; FREE ENERGY; MOLECULAR DYNAMICS; THREE DIMENSIONAL COMPUTER GRAPHICS; VIRUSES;

THREE DIMENSIONAL;

LIGAND; OSELTAMIVIR; VIRUS SIALIDASE; SIALIDASE;

2009 H1N1 INFLUENZA; ARTICLE; BINDING SITE; CONTROLLED STUDY; CRYSTALLIZATION; ENZYME ACTIVE SITE; MOLECULAR DOCKING; MOLECULAR DYNAMICS; SEQUENCE HOMOLOGY; SIMULATION; THREE DIMENSIONAL IMAGING; VIRUS MUTATION; AMINO ACID SEQUENCE; ANTAGONISTS AND INHIBITORS; CHEMISTRY; ENZYMOLOGY; GENETICS; HUMAN; INFLUENZA; INFLUENZA A VIRUS (H1N1); MUTATION; SEQUENCE ALIGNMENT; VIROLOGY;

AMINO ACID SEQUENCE; BINDING SITES; HUMANS; INFLUENZA A VIRUS, H1N1 SUBTYPE; INFLUENZA, HUMAN; MOLECULAR DYNAMICS SIMULATION; MUTATION; NEURAMINIDASE; OSELTAMIVIR; SEQUENCE ALIGNMENT;

EID: 84867841322     PISSN: 00063525     EISSN: 10970282     Source Type: Journal    
DOI: 10.1002/bip.22130     Document Type: Article

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