A quantum mechanics/molecular mechanics study on the hydrolysis mechanism of New Delhi metallo-β-lactamase-1
Published 2013 View Full Article
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Title
A quantum mechanics/molecular mechanics study on the hydrolysis mechanism of New Delhi metallo-β-lactamase-1
Authors
Keywords
QM/MM, NDM-1, MD, Catalytic mechanism, β-Lactam antibiotics
Journal
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
Volume 27, Issue 3, Pages 247-256
Publisher
Springer Nature
Online
2013-03-02
DOI
10.1007/s10822-012-9630-6
References
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Related references
Note: Only part of the references are listed.- Mechanistic and Spectroscopic Studies of Metallo-β-lactamase NDM-1
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- Structure of New Delhi metallo-β-lactamase 1 (NDM-1)
- (2011) Victoria L. Green et al. Acta Crystallographica Section F-Structural Biology and Crystallization Communications
- Genetic Features ofblaNDM-1-Positive Enterobacteriaceae
- (2011) Laurent Poirel et al. ANTIMICROBIAL AGENTS AND CHEMOTHERAPY
- Carbapenems: Past, Present, and Future
- (2011) Krisztina M. Papp-Wallace et al. ANTIMICROBIAL AGENTS AND CHEMOTHERAPY
- Characterization of Purified New Delhi Metallo-β-lactamase-1
- (2011) Pei W. Thomas et al. BIOCHEMISTRY
- Crystal structure of NDM-1 reveals a common β-lactam hydrolysis mechanism
- (2011) HongMin Zhang et al. FASEB JOURNAL
- Dissemination of NDM-1 positive bacteria in the New Delhi environment and its implications for human health: an environmental point prevalence study
- (2011) Timothy R Walsh et al. LANCET INFECTIOUS DISEASES
- Molecular Basis of NDM-1, a New Antibiotic Resistance Determinant
- (2011) Zhongjie Liang et al. PLoS One
- Structure of Apo- and Monometalated Forms of NDM-1—A Highly Potent Carbapenem-Hydrolyzing Metallo-β-Lactamase
- (2011) Youngchang Kim et al. PLoS One
- Crystal structure of New Delhi metallo-β-lactamase reveals molecular basis for antibiotic resistance
- (2011) Dustin King et al. PROTEIN SCIENCE
- The emerging NDM carbapenemases
- (2011) Patrice Nordmann et al. TRENDS IN MICROBIOLOGY
- A structural view of the antibiotic degradation enzyme NDM-1 from a superbug
- (2011) Yu Guo et al. Protein & Cell
- Three Decades of -Lactamase Inhibitors
- (2010) S. M. Drawz et al. CLINICAL MICROBIOLOGY REVIEWS
- Activity of aminoglycosides, including ACHN-490, against carbapenem-resistant Enterobacteriaceae isolates
- (2010) D. M. Livermore et al. JOURNAL OF ANTIMICROBIAL CHEMOTHERAPY
- Structural Survey of Zinc-Containing Proteins and Development of the Zinc AMBER Force Field (ZAFF)
- (2010) Martin B. Peters et al. Journal of Chemical Theory and Computation
- QM/MM Studies of Monozinc β-Lactamase CphA Suggest That the Crystal Structure of an Enzyme−Intermediate Complex Represents a Minor Pathway
- (2010) Shanshan Wu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Emergence of a new antibiotic resistance mechanism in India, Pakistan, and the UK: a molecular, biological, and epidemiological study
- (2010) Karthikeyan K Kumarasamy et al. LANCET INFECTIOUS DISEASES
- Updated Functional Classification of -Lactamases
- (2009) K. Bush et al. ANTIMICROBIAL AGENTS AND CHEMOTHERAPY
- Characterization of a New Metallo- -Lactamase Gene, blaNDM-1, and a Novel Erythromycin Esterase Gene Carried on a Unique Genetic Structure in Klebsiella pneumoniae Sequence Type 14 from India
- (2009) D. Yong et al. ANTIMICROBIAL AGENTS AND CHEMOTHERAPY
- β-Lactamase Inhibitors: The Story so Far
- (2009) Francisco Perez-Llarena et al. CURRENT MEDICINAL CHEMISTRY
- Common Mechanistic Features among Metallo-β-lactamases
- (2009) Fabio Simona et al. JOURNAL OF BIOLOGICAL CHEMISTRY
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