3D-QSAR, Molecular Docking and Molecular Dynamics Simulation of Pseudomonas aeruginosa LpxC Inhibitors

Synthesis and biological evaluation of enantiomerically pure glyceric acid derivatives as LpxC inhibitors

(2016) Giovanni Tangherlini et al.   BIOORGANIC & MEDICINAL CHEMISTRY

Insights into the Zinc-Dependent Deacetylase LpxC: Biochemical Properties and Inhibitor Design

(2016) Dmitrii V. Kalinin et al.   CURRENT TOPICS IN MEDICINAL CHEMISTRY

Chiral pool synthesis and biological evaluation of C-furanosidic and acyclic LpxC inhibitors

(2016) Hannes Müller et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

High susceptibility of MDR and XDR Gram-negative pathogens to biphenyl-diacetylene-based difluoromethyl-allo-threonyl-hydroxamate LpxC inhibitors

(2016) Marie Titecat et al.   JOURNAL OF ANTIMICROBIAL CHEMOTHERAPY

MCPB.py: A Python Based Metal Center Parameter Builder

(2016) Pengfei Li et al.   Journal of Chemical Information and Modeling

Colistin resistance gene mcr-1 and pHNSHP45 plasmid in human isolates of Escherichia coli and Klebsiella pneumoniae

(2016) Nicole Stoesser et al.   LANCET INFECTIOUS DISEASES

Nosocomial Infections Caused byAcinetobacter baumannii: Are We Losing the Battle?

(2016) Dragana Protic et al.   Surgical Infections

LpxC Inhibitors: Design, Synthesis, and Biological Evaluation of Oxazolidinones as Gram-negative Antibacterial Agents

(2016) Haruaki Kurasaki et al.   ACS Medicinal Chemistry Letters

Activation of EP4receptors prevents endotoxin-induced neutrophil infiltration into the airways and enhances microvascular barrier function

(2015) V Konya et al.   BRITISH JOURNAL OF PHARMACOLOGY

Design, synthesis and biological evaluation of LpxC inhibitors with novel hydrophilic terminus

(2015) Shi Ding et al.   CHINESE CHEMICAL LETTERS

Structural Properties of the Water/Membrane Interface of a Bilayer Built of the E. coli Lipid A

(2015) Krzysztof Murzyn et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Crystal structure ofA. aeolicusLpxC with bound product suggests alternate deacetylation mechanism

(2015) Matthew D. Miller et al.   PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS

Synthesis and biological evaluation of C-ethynyl furanosides as LpxC inhibitors

(2015) Sunit Kumar Jana et al.   TETRAHEDRON

LpxC Inhibitors as Effective Therapy Against Multidrug Resistant Bacterial Infections

(2015) Ahmed F. Abdel-Magid   ACS Medicinal Chemistry Letters

A Complete Pathway Model for Lipid A Biosynthesis in Escherichia coli

(2015) Akintunde Emiola et al.   PLoS One

AutoDock4Zn: An Improved AutoDock Force Field for Small-Molecule Docking to Zinc Metalloproteins

(2014) Diogo Santos-Martins et al.   Journal of Chemical Information and Modeling

Exploring the UDP pocket of LpxC through amino acid analogs

(2013) Michael R. Hale et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Structure of the Bacterial Deacetylase LpxC Bound to the Nucleotide Reaction Product Reveals Mechanisms of Oxyanion Stabilization and Proton Transfer

(2013) Gina M. Clayton et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Study on the interactions between diketo-acid inhibitors and prototype foamy virus integrase-DNA complex via molecular docking and comparative molecular dynamics simulation methods

(2012) Jian-Ping Hu et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Pyridone Methylsulfone Hydroxamate LpxC Inhibitors for the Treatment of Serious Gram-Negative Infections

(2012) Justin I. Montgomery et al.   JOURNAL OF MEDICINAL CHEMISTRY

Configurational entropy: an improvement of the quasiharmonic approximation using configurational temperature

(2011) Phuong H. Nguyen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Species-Specific and Inhibitor-Dependent Conformations of LpxC: Implications for Antibiotic Design

(2010) Chul-Jin Lee et al.   CHEMISTRY & BIOLOGY

Mechanism and Inhibition of LpxC: An Essential Zinc-Dependent Deacetylase of Bacterial Lipid A Synthesis

(2008) Pei Zhou et al.   CURRENT PHARMACEUTICAL BIOTECHNOLOGY

DFT Investigation on the Mechanism of the Deacetylation Reaction Catalyzed by LpxC

(2008) Jesse J. Robinet et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Study on the molecular mechanism of inhibiting HIV-1 integrase by EBR28 peptide via molecular modeling approach

(2007) Jian Ping Hu et al.   BIOPHYSICAL CHEMISTRY