(Q35570052)

8 August 2017

title

Novel inhibitors of Mycobacterium tuberculosis dTDP-6-deoxy-L-lyxo-4-hexulose reductase (RmlD) identified by virtual screening (English)

1 reference

Mycobacterium tuberculosis

8 August 2017

main subject

1 reference

6

J Andrew McCammon

1 reference

8 August 2017

Yi Wang

1

1 reference

8 August 2017

Tamara Noelle Hess

2

1 reference

8 August 2017

Victoria Jones

3

1 reference

8 August 2017

Joe Zhongxiang Zhou

4

1 reference

8 August 2017

Michael R McNeil

5

1 reference

8 August 2017

language of work or name

English

0 references

publication date

29 September 2011

1 reference

Bioorganic & Medicinal Chemistry Letters

8 August 2017

published in

1 reference

8 August 2017

volume

21

1 reference

8 August 2017

issue

23

1 reference

8 August 2017

page(s)

7064-7067

1 reference

Complementarity Between a Docking and a High-Throughput Screen in Discovering New Cruzain Inhibitors

8 August 2017

cites work

1 reference

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12 July 2018

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New drugs and new regimens for the treatment of tuberculosis: review of the drug development pipeline and implications for national programmes

12 July 2018

1 reference

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Identification of triazinoindol-benzimidazolones as nanomolar inhibitors of the Mycobacterium tuberculosis enzyme TDP-6-deoxy-d-xylo-4-hexopyranosid-4-ulose 3,5-epimerase (RmlC)

12 July 2018

1 reference

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Discovery, synthesis, and biological evaluation of piperidinol analogs with anti-tuberculosis activity

12 July 2018

1 reference

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Targeting the formation of the cell wall core of M. tuberculosis

12 July 2018

1 reference

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12 July 2018

1 reference

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Challenges in tuberculosis drug research and development

12 July 2018

1 reference

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Extra precision glide: docking and scoring incorporating a model of hydrophobic enclosure for protein-ligand complexes

12 July 2018

1 reference

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Pathway to synthesis and processing of mycolic acids in Mycobacterium tuberculosis

12 July 2018

1 reference

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Glide: a new approach for rapid, accurate docking and scoring. 2. Enrichment factors in database screening

12 July 2018

1 reference

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Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Multiple sequence alignment with the Clustal series of programs

12 July 2018

1 reference

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Genes required for mycobacterial growth defined by high density mutagenesis

12 July 2018

1 reference

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Variation on a theme of SDR. dTDP-6-deoxy-L- lyxo-4-hexulose reductase (RmlD) shows a new Mg2+-dependent dimerization mode

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Formation of dTDP-rhamnose is essential for growth of mycobacteria

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Cell wall core galactofuran synthesis is essential for growth of mycobacteria

12 July 2018

1 reference

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Drug targeting Mycobacterium tuberculosis cell wall synthesis: genetics of dTDP-rhamnose synthetic enzymes and development of a microtiter plate-based screen for inhibitors of conversion of dTDP-glucose to dTDP-rhamnose

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Modeling of loops in protein structures

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Comparative protein structure modeling of genes and genomes

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Gossypol: prototype of inhibitors targeted to dinucleotide folds

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Construction and use of low-copy number T7 expression vectors for purification of problem proteins: purification of mycobacterium tuberculosis RmlD and pseudomonas aeruginosa LasI and RhlI proteins, and functional analysis of purified RhlI

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Conversion of dTDP-4-keto-6-deoxyglucose to free dTDP-4-keto-rhamnose by the rmIC gene products of Escherichia coli and Mycobacterium tuberculosis

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Mycolic acids: structure, biosynthesis and physiological functions

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Can penicillins and other beta-lactam antibiotics be used to treat tuberculosis?

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Comparative protein modelling by satisfaction of spatial restraints

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Prevention of drug access to bacterial targets: permeability barriers and active efflux

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Recognition of multiple effects of ethambutol on metabolism of mycobacterial cell envelope

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Permeability barrier to hydrophilic solutes in Mycobacterium chelonei

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Bio3d: an R package for the comparative analysis of protein structures.

12 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

17-beta-Hydroxysteroid dehydrogenase type 1: computational design of active site inhibitors targeted to the Rossmann fold

26 September 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Characterization of dTDP-4-dehydrorhamnose 3,5-epimerase and dTDP-4-dehydrorhamnose reductase, required for dTDP-L-rhamnose biosynthesis in Salmonella enterica serovar Typhimurium LT2.

26 September 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3223023

Evidence for the nature of the link between the arabinogalactan and peptidoglycan of mycobacterial cell walls

26 September 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22014548

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1016/J.BMCL.2011.09.094

1 reference

8 August 2017

1 reference

8 August 2017

1 reference