Identification of natural small molecule modulators of MurB from Salmonella enterica serovar Typhi Ty2 strain using computational and biophysical approaches

Keyphrases

• Salmonella Typhi (S. Typhi) 100%
• Biophysical Approach 100%
• Computational Approach 100%
• Quercetin 100%
• Small Molecule Modulators 100%
• Peptidoglycan Synthesis 100%
• Natural Small Molecules 100%
• MurB 100%
• Nicotinamide Adenine Dinucleotide Phosphate (NADPH) 66%
• Natural Compounds 66%
• Berberine 66%
• Scopoletin 66%
• Therapeutic Intervention 33%
• Antibiotics 33%
• Denaturation 33%
• Binding Studies 33%
• Chemically Induced 33%
• Urea 33%
• Drug Discovery 33%
• Reductase 33%
• Drug Target 33%
• Molecular Interactions 33%
• Thermodynamic Stability 33%
• Antibiotic Resistant 33%
• Molecular Dynamics Simulation 33%
• Bacterial Pathogens 33%
• Bacterial Replication 33%
• Binding Affinity 33%
• Biophysical Characterization 33%
• Drug Class 33%
• Novel Class 33%
• Stronger Binding 33%
• Bound Form 33%
• GdnHCl 33%
• Chemical Denaturants 33%
• Circular Dichroism 33%
• Differential Scanning Calorimetry 33%
• Thermal Melting 33%
• Osmotic Pressure 33%
• Cell Shape 33%
• Complex Stability 33%
• Biosynthesis Pathway 33%
• In Silico Virtual Screening 33%
• Fluorescence Binding Assay 33%
• Melting Profile 33%
• Mur Ligases 33%
• Bacterial Cell Wall Synthesis 33%

Biochemistry, Genetics and Molecular Biology

• Anabolism 100%
• Enzyme 100%
• Small Molecule 100%
• Salmonella Enterica Serovar Typhi 100%
• Peptidoglycan 100%
• Quercetin 100%
• Scopoletin 66%
• Binding Affinity 33%
• Infectious Agent 33%
• Binding Study 33%
• Oxidoreductase 33%
• Reductase 33%
• Molecular Interaction 33%
• Circular Dichroism 33%
• Denaturation 33%
• Ligase 33%
• Melting Point 33%
• Uridine Diphosphate 33%
• Differential Scanning Calorimetry 33%
• Bacterial Cell Wall 33%
• Cell Shape 33%
• Computer Simulation 33%

Pharmacology, Toxicology and Pharmaceutical Science

• Peptidoglycan 100%
• Salmonella Enterica Serovar Typhi 100%
• Quercetin 100%
• Reduced Nicotinamide Adenine Dinucleotide Phosphate 66%
• Natural Product 66%
• Berberine 66%
• Scopoletin 66%
• Infectious Agent 33%
• Antibiotics 33%
• Drug Discovery 33%
• Virtual Screening 33%
• Oxidoreductase 33%
• Differential Scanning Calorimetry 33%
• Ligase 33%
• Uridine Diphosphate 33%