[HTML][HTML] Design and synthesis of novel antimicrobial agents

Z Breijyeh, R Karaman - Antibiotics, 2023 - mdpi.com
The necessity for the discovery of innovative antimicrobials to treat life-threatening diseases
has increased as multidrug-resistant bacteria has spread. Due to antibiotics' availability over …

[PDF][PDF] Protein crystallography and drug discovery: recollections of knowledge exchange between academia and industry

TL Blundell - IUCrJ, 2017 - journals.iucr.org
The development of structure-guided drug discovery is a story of knowledge exchange
where new ideas originate from all parts of the research ecosystem. Dorothy Crowfoot …

Arginine-deprivation–induced oxidative damage sterilizes Mycobacterium tuberculosis

S Tiwari, AJ Van Tonder, C Vilchèze… - Proceedings of the …, 2018 - National Acad Sciences
Reactive oxygen species (ROS)-mediated oxidative stress and DNA damage have recently
been recognized as contributing to the efficacy of most bactericidal antibiotics, irrespective of …

Fragment-Based Approach to Targeting Inosine-5′-monophosphate Dehydrogenase (IMPDH) from Mycobacterium tuberculosis

A Trapero, A Pacitto, V Singh, M Sabbah… - Journal of medicinal …, 2018 - ACS Publications
Tuberculosis (TB) remains a major cause of mortality worldwide, and improved treatments
are needed to combat emergence of drug resistance. Inosine 5′-monophosphate …

Structure-guided fragment-based drug discovery at the synchrotron: screening binding sites and correlations with hotspot mapping

SE Thomas, P Collins, RH James… - … of the Royal …, 2019 - royalsocietypublishing.org
Structure-guided drug discovery emerged in the 1970s and 1980s, stimulated by the three-
dimensional structures of protein targets that became available, mainly through X-ray crystal …

Fragment-Based Design of Mycobacterium tuberculosis InhA Inhibitors

M Sabbah, V Mendes, RG Vistal… - Journal of medicinal …, 2020 - ACS Publications
Tuberculosis (TB) remains a leading cause of mortality among infectious diseases
worldwide. InhA has been the focus of numerous drug discovery efforts as this is the target of …

Development of Inhibitors of SAICAR Synthetase (PurC) from Mycobacterium abscessus Using a Fragment-Based Approach

S Charoensutthivarakul, SE Thomas… - ACS infectious …, 2022 - ACS Publications
Mycobacterium abscessus (Mab) has emerged as a challenging threat to individuals with
cystic fibrosis. Infections caused by this pathogen are often impossible to treat due to the …

[HTML][HTML] A fragment-based approach to assess the ligandability of ArgB, ArgC, ArgD and ArgF in the L-arginine biosynthetic pathway of Mycobacterium tuberculosis

P Gupta, SE Thomas, SA Zaidan, MA Pasillas… - Computational and …, 2021 - Elsevier
The L-arginine biosynthesis pathway consists of eight enzymes that catalyse the conversion
of L-glutamate to L-arginine. Arginine auxotrophs (argB/argF deletion mutants) of …

Mycobacterial genomics and structural bioinformatics: opportunities and challenges in drug discovery

VP Waman, SC Vedithi, SE Thomas… - Emerging microbes & …, 2019 - Taylor & Francis
Of the more than 190 distinct species of Mycobacterium genus, many are economically and
clinically important pathogens of humans or animals. Among those mycobacteria that infect …

[HTML][HTML] Biosynthesis of Galactan in Mycobacterium tuberculosis as a Viable TB Drug Target?

Z Konyariková, K Savková, S Kozmon, K Mikušová - Antibiotics, 2020 - mdpi.com
While target-based drug design has proved successful in several therapeutic areas, this
approach has not yet provided compelling outcomes in the field of antibacterial agents. This …