QM/MM simulations as an assay for carbapenemase activity in class A β-lactamases

Combined Quantum Mechanics/Molecular Mechanics (QM/MM) Methods in Computational Enzymology

(2013) Marc W. van der Kamp et al.   BIOCHEMISTRY

The Basis for Carbapenem Hydrolysis by Class A β-Lactamases: A Combined Investigation using Crystallography and Simulations

(2012) Fátima Fonseca et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structural Basis for Progression toward the Carbapenemase Activity in the GES Family of β-Lactamases

(2012) Clyde A. Smith et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Current Epidemiology and Growing Resistance of Gram-Negative Pathogens

(2012) David M. Livermore   KOREAN JOURNAL OF INTERNAL MEDICINE

Exploring the Inhibition of CTX-M-9 by β-Lactamase Inhibitors and Carbapenems

(2011) Christopher R. Bethel et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Carbapenems: Past, Present, and Future

(2011) Krisztina M. Papp-Wallace et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Substrate Selectivity and a Novel Role in Inhibitor Discrimination by Residue 237 in the KPC-2  -Lactamase

(2010) K. M. Papp-Wallace et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Emerging carbapenemases: a global perspective

(2010) Timothy R. Walsh   INTERNATIONAL JOURNAL OF ANTIMICROBIAL AGENTS

Elucidating the role of Trp105 in the KPC-2 β-lactamase

(2010) Krisztina M. Papp-Wallace et al.   PROTEIN SCIENCE

Hydrolysis and Inhibition Profiles of  -Lactamases from Molecular Classes A to D with Doripenem, Imipenem, and Meropenem

(2009) A. M. Queenan et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Mechanistic Basis for the Emergence of Catalytic Competence against Carbapenem Antibiotics by the GES Family of β-Lactamases

(2009) Hilary Frase et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

High Level QM/MM Modeling of the Formation of the Tetrahedral Intermediate in the Acylation of Wild Type and K73A Mutant TEM-1 Class A β-Lactamase†

(2009) Johannes C. Hermann et al.   JOURNAL OF PHYSICAL CHEMISTRY A

The real threat of Klebsiella pneumoniae carbapenemase-producing bacteria

(2009) Patrice Nordmann et al.   LANCET INFECTIOUS DISEASES

Meropenem-Clavulanate Is Effective Against Extensively Drug-Resistant Mycobacterium tuberculosis

(2009) J.-E. Hugonnet et al.   SCIENCE

Genetic and Structural Insights into the Dissemination Potential of the Extremely Broad-Spectrum Class A  -Lactamase KPC-2 Identified in an Escherichia coli Strain and an Enterobacter cloacae Strain Isolated from the Same Patient in France

(2008) S. Petrella et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Carbapenems and SHV-1 β-Lactamase Form Different Acyl-Enzyme Populations in Crystals and Solution†

(2008) Matthew Kalp et al.   BIOCHEMISTRY

Inhibition of Class A β-Lactamases by Carbapenems: Crystallographic Observation of Two Conformations of Meropenem in SHV-1

(2008) Michiyosi Nukaga et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY