In silico quest for putative drug targets in Helicobacter pylori HPAG1: Molecular modeling of candidate enzymes from lipopolysaccharide biosynthesis pathway

Journal of Molecular Modeling

Volumn 18, Issue 5, 2012, Pages 1855-1865

  Sarkar, Munmun ^a   Maganti, Lakshmi ^a   Ghoshal, Nanda ^a   Dutta, Chitra ^a  

^a INDIAN INSTITUTE OF CHEMICAL BIOLOGY   (India)

Author keywords

Binding site analysis; Differential pathway analysis; Essential proteins; Homology modeling; Molecular docking

Indexed keywords

2 DEHYDRO 3 DEOXYPHOSPHOOCTONATE ALDOLASE; AMINO ACID; BACTERIAL PROTEIN; BACTERIUM LIPOPOLYSACCHARIDE; ENZYME; FRUCTOSE BISPHOSPHATE ALDOLASE; ISOMERASE; LIGAND; MONOMER; PHOSPHOHEPTOSE ISOMERASE; PROTEIN HPAG1; UNCLASSIFIED DRUG; URIDINE DIPHOSPHATE 3 O (3 HYDROXYMYRISTOYL) N ACETYLGLUCOSAMINE DEACETYLASE;

ARTICLE; BACTERIAL METABOLISM; BACTERIAL VIRULENCE; BINDING SITE; BIOSYNTHESIS; DRUG TARGETING; ENZYME SUBSTRATE COMPLEX; HELICOBACTER PYLORI; MOLECULAR DOCKING; MOLECULAR INTERACTION; MOLECULAR MODEL; NONHUMAN; PEPTIC ULCER; PRIORITY JOURNAL; STOMACH CANCER;

ALDEHYDE-LYASES; ALDOSE-KETOSE ISOMERASES; AMIDOHYDROLASES; AMINO ACID SEQUENCE; AMINO ACIDS; BACTERIAL PROTEINS; BINDING SITES; COMPUTER SIMULATION; DATABASES, PROTEIN; DRUG DESIGN; HELICOBACTER PYLORI; HUMANS; LIGANDS; LIPOPOLYSACCHARIDES; METABOLOME; MODELS, MOLECULAR; MOLECULAR SEQUENCE DATA; PHOSPHOENOLPYRUVATE; PROTEIN BINDING; STRUCTURAL HOMOLOGY, PROTEIN; THERMODYNAMICS;

HELICOBACTER PYLORI;

EID: 84861227091     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-011-1204-3     Document Type: Article

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