Benzimidazole and Benzoxazole Zinc Chelators as Inhibitors of Metallo‐β‐Lactamase NDM‐1

Discovery of the Novel Inhibitor Against New Delhi Metallo-β-Lactamase Based on Virtual Screening and Molecular Modelling

(2020) Xiyan Wang et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Interplay between β-lactamases and new β-lactamase inhibitors

(2019) Karen Bush et al.   NATURE REVIEWS MICROBIOLOGY

3D-QSAR and molecular recognition of Klebsiella pneumoniae NDM-1 inhibitors

(2019) Huaichuan Duan et al.   MOLECULAR SIMULATION

The Continuing Challenge of Metallo-β-Lactamase Inhibition: Mechanism Matters

(2018) Lin-Cheng Ju et al.   TRENDS IN PHARMACOLOGICAL SCIENCES

Copper Influences the Antibacterial Outcomes of a β-Lactamase-Activated Prochelator against Drug-Resistant Bacteria

(2018) Jacqueline M. Zaengle-Barone et al.   ACS Infectious Diseases

Ten Years with New Delhi Metallo-β-lactamase-1 (NDM-1): From Structural Insights to Inhibitor Design

(2018) Pasquale Linciano et al.   ACS Infectious Diseases

Role for dithiolopyrrolones in disrupting bacterial metal homeostasis

(2017) Andrew N. Chan et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Microstructural properties and enhanced photocatalytic performance of Zn doped CeO2 nanocrystals

(2017) M. A. Majeed Khan et al.   Scientific Reports

Exploring the importance of zinc binding and steric/hydrophobic factors in novel HCV replication inhibitors

(2016) Daniel C. Talley et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Role of Non-Active-Site Residue Trp-93 in the Function and Stability of New Delhi Metallo-β-Lactamase 1

(2015) Asad U. Khan et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

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

Metallo-β-lactamase: Inhibitors and reporter substrates

(2013) Walter Fast et al.   BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS

UK-1 and structural analogs are potent inhibitors of hepatitis C virus replication

(2013) Dawn N. Ward et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Metallo-β-lactamase structure and function

(2012) Timothy Palzkill   Annals of the New York Academy of Sciences

A Potential Substrate Binding Conformation of β-Lactams and Insight into the Broad Spectrum of NDM-1 Activity

(2012) Qinghui Yuan et al.   ANTIMICROBIAL AGENTS AND CHEMOTHERAPY

Avogadro: an advanced semantic chemical editor, visualization, and analysis platform

(2012) Marcus D Hanwell et al.   Journal of Cheminformatics

Crystal structure of NDM-1 reveals a common β-lactam hydrolysis mechanism

(2011) HongMin Zhang et al.   FASEB JOURNAL

LigPlot+: Multiple Ligand–Protein Interaction Diagrams for Drug Discovery

(2011) Roman A. Laskowski et al.   Journal of Chemical Information and Modeling

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

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

(2009) Oleg Trott et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

(2009) Garrett M. Morris et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY