List of works - Donatella Tondi

Can We Exploit β-Lactamases Intrinsic Dynamics for Designing More Effective Inhibitors?

scientific article published on 21 November 2020

Computational and biological profile of boronic acids for the detection of bacterial serine- and metallo-β-lactamases.

scientific article published on 18 December 2017

Conformational Propensity and Biological Studies of Proline Mutated LR Peptides Inhibiting Human Thymidylate Synthase and Ovarian Cancer Cell Growth

scientific article published on 13 August 2018

Conformational analysis of phthalein derivatives acting as thymidylate synthase inhibitors by means of 1H NMR and quantum chemical calculations

scientific article published on 01 October 1996

Constrained dansyl derivatives reveal bacterial specificity of highly conserved thymidylate synthases

scientific article published in March 2008

Decoding the Structural Basis For Carbapenem Hydrolysis By Class A β-lactamases: Fishing For A Pharmacophore

scientific article published on 30 September 2015

First virtual screening and experimental validation of inhibitors targeting GES-5 carbapenemase

scientific article published on 02 January 2019

Improving specificity vs bacterial thymidylate synthases through N-dansyl modulation of didansyltyrosine

scientific article published in February 2005

Mono- and disubstituted-3,8-diazabicyclo[3.2.1]octane derivatives as analgesics structurally related to epibatidine: synthesis, activity, and modeling

scientific article published in February 1998

Naphthalimido derivatives as antifolate thymidylate synthase inhibitors

Optimizing cell permeation of an antibiotic resistance inhibitor for improved efficacy

scientific article

Phenylboronic Acid Derivatives as Validated Leads Active in Clinical Strains Overexpressing KPC-2: A Step against Bacterial Resistance.

scientific article published on 22 January 2018

Phthalein derivatives as a new tool for selectivity in thymidylate synthase inhibition

scientific article

Predicting and harnessing protein flexibility in the design of species-specific inhibitors of thymidylate synthase

scientific article

Predicting and harnessing protein flexibility in the design of species-specific inhibitors of thymidylate synthase1,21Escherichia coli thymidylate synthase numbering is used unless otherwise noted.2PDB coordinates have been deposited with the RCSB wi

article published in 2001

Protein-protein interface-binding peptides inhibit the cancer therapy target human thymidylate synthase

scientific article

SOS response in bacteria: Inhibitory activity of lichen secondary metabolites against Escherichia coli RecA protein

scientific article published on 08 April 2017

Structural study of phenyl boronic acid derivatives as AmpC β-lactamase inhibitors

scientific article

Structure-Based Virtual Screening for the Discovery of Novel Inhibitors of New Delhi Metallo-β-lactamase-1.

scientific article published on 26 November 2017

Structure-based design and in-parallel synthesis of inhibitors of AmpC beta-lactamase

scientific article

Structure-based design of inhibitors specific for bacterial thymidylate synthase

scientific article

Structure-based discovery and in-parallel optimization of novelcompetitive inhibitors of thymidylate synthase

scientific article published on 01 May 1999

Structure-based optimization of a non-beta-lactam lead results in inhibitors that do not up-regulate beta-lactamase expression in cell culture

scientific article published on April 2005

Structure-based studies on species-specific inhibition of thymidylate synthase

scientific article (publication date: 18 July 2002)

Targeting Class A and C Serine β-Lactamases with a Broad-Spectrum Boronic Acid Derivative

scientific article

Targeting the Class A Carbapenemase GES-5 via Virtual Screening

scientific article published on 14 February 2020

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

scientific article published on 28 November 2018

The inhibition of extended spectrum β-lactamases: hits and leads

scientific article published on January 2014

Thymidylate synthase structure, function and implication in drug discovery.

scientific article

X-ray Crystallography Deciphers the Activity of Broad-Spectrum Boronic Acid β-Lactamase Inhibitors

scientific article published on 27 March 2019

ortho-Halogen naphthaleins as specific inhibitors of Lactobacillus casei thymidylate synthase. Conformational properties and biological activity

scientific article

List of works by Donatella Tondi

Can We Exploit β-Lactamases Intrinsic Dynamics for Designing More Effective Inhibitors?

Computational and biological profile of boronic acids for the detection of bacterial serine- and metallo-β-lactamases.

Conformational Propensity and Biological Studies of Proline Mutated LR Peptides Inhibiting Human Thymidylate Synthase and Ovarian Cancer Cell Growth

Conformational analysis of phthalein derivatives acting as thymidylate synthase inhibitors by means of 1H NMR and quantum chemical calculations

Constrained dansyl derivatives reveal bacterial specificity of highly conserved thymidylate synthases

Decoding the Structural Basis For Carbapenem Hydrolysis By Class A β-lactamases: Fishing For A Pharmacophore

First virtual screening and experimental validation of inhibitors targeting GES-5 carbapenemase

Improving specificity vs bacterial thymidylate synthases through N-dansyl modulation of didansyltyrosine

Mono- and disubstituted-3,8-diazabicyclo[3.2.1]octane derivatives as analgesics structurally related to epibatidine: synthesis, activity, and modeling

Naphthalimido derivatives as antifolate thymidylate synthase inhibitors

Optimizing cell permeation of an antibiotic resistance inhibitor for improved efficacy

Phenylboronic Acid Derivatives as Validated Leads Active in Clinical Strains Overexpressing KPC-2: A Step against Bacterial Resistance.

Phthalein derivatives as a new tool for selectivity in thymidylate synthase inhibition

Predicting and harnessing protein flexibility in the design of species-specific inhibitors of thymidylate synthase

Predicting and harnessing protein flexibility in the design of species-specific inhibitors of thymidylate synthase1,21Escherichia coli thymidylate synthase numbering is used unless otherwise noted.2PDB coordinates have been deposited with the RCSB wi

Protein-protein interface-binding peptides inhibit the cancer therapy target human thymidylate synthase

SOS response in bacteria: Inhibitory activity of lichen secondary metabolites against Escherichia coli RecA protein

Structural study of phenyl boronic acid derivatives as AmpC β-lactamase inhibitors

Structure-Based Virtual Screening for the Discovery of Novel Inhibitors of New Delhi Metallo-β-lactamase-1.

Structure-based design and in-parallel synthesis of inhibitors of AmpC beta-lactamase

Structure-based design of inhibitors specific for bacterial thymidylate synthase

Structure-based discovery and in-parallel optimization of novelcompetitive inhibitors of thymidylate synthase

Structure-based optimization of a non-beta-lactam lead results in inhibitors that do not up-regulate beta-lactamase expression in cell culture

Structure-based studies on species-specific inhibition of thymidylate synthase

Targeting Class A and C Serine β-Lactamases with a Broad-Spectrum Boronic Acid Derivative

Targeting the Class A Carbapenemase GES-5 via Virtual Screening

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

The inhibition of extended spectrum β-lactamases: hits and leads

Thymidylate synthase structure, function and implication in drug discovery.

X-ray Crystallography Deciphers the Activity of Broad-Spectrum Boronic Acid β-Lactamase Inhibitors

ortho-Halogen naphthaleins as specific inhibitors of Lactobacillus casei thymidylate synthase. Conformational properties and biological activity