QM/MM molecular dynamics study of the galactopyranose → galactofuranose reaction catalysed by Trypanosoma cruzi UDP-galactopyranose mutase (Q35315473)

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English	QM/MM molecular dynamics study of the galactopyranose → galactofuranose reaction catalysed by Trypanosoma cruzi UDP-galactopyranose mutase	scientific article

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scholarly article

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Europe PubMed Central

PubMed publication ID

7 August 2017

QM/MM molecular dynamics study of the galactopyranose → galactofuranose reaction catalysed by Trypanosoma cruzi UDP-galactopyranose mutase (English)

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Europe PubMed Central

PubMed publication ID

7 August 2017

Trypanosoma cruzi

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Gustavo Pierdominici-Sottile

1

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25299056 AND SRC:MED&resulttype=core&format=json

5 June 2020

4

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5 June 2020

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Rodrigo Cossio Pérez

2

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25299056 AND SRC:MED&resulttype=core&format=json

5 June 2020

Johan F Galindo

3

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5 June 2020

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9 October 2014

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7 August 2017

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5 June 2020

9

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5 June 2020

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5 June 2020

e109559

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5 June 2020

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Creative Commons Attribution 4.0 International

9 October 2014

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April 2022 Public Data File from Crossref

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Structure, mechanism, and dynamics of UDP-galactopyranose mutase

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Substrate-dependent dynamics of UDP-galactopyranose mutase: Implications for drug design

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Targeting UDP-galactopyranose mutases from eukaryotic human pathogens

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Crystal Structures of Trypanosoma cruzi UDP-Galactopyranose Mutase Implicate Flexibility of the Histidine Loop in Enzyme Activation

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27 July 2018

Towards the crystal structure elucidation of eukaryotic UDP-galactopyranose mutase

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27 July 2018

Chemical mechanism of UDP-galactopyranose mutase from Trypanosoma cruzi: a potential drug target against Chagas' disease

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Crystal Structures and Small-angle X-ray Scattering Analysis of UDP-galactopyranose Mutase from the Pathogenic Fungus Aspergillus fumigatus

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Nucleophilic participation of reduced flavin coenzyme in mechanism of UDP-galactopyranose mutase

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Free energy study of the catalytic mechanism of Trypanosoma cruzi trans-sialidase. From the Michaelis complex to the covalent intermediate.

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27 July 2018

Galactofuranose in eukaryotes: aspects of biosynthesis and functional impact.

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27 July 2018

Biosynthesis of Galactofuranose in Kinetoplastids: Novel Therapeutic Targets for Treating Leishmaniasis and Chagas' Disease

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Proton transfer facilitated by ligand binding. An energetic analysis of the catalytic mechanism of Trypanosoma cruzi trans-sialidase.

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Ring puckering: a metric for evaluating the accuracy of AM1, PM3, PM3CARB-1, and SCC-DFTB carbohydrate QM/MM simulations

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27 July 2018

Chemoenzymatic synthesis, inhibition studies, and X-ray crystallographic analysis of the phosphono analog of UDP-Galp as an inhibitor and mechanistic probe for UDP-galactopyranose mutase

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Internal proton transfer in the external pyridoxal 5'-phosphate Schiff base in dopa decarboxylase

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Structural basis of substrate binding to UDP-galactopyranose mutase: crystal structures in the reduced and oxidized state complexed with UDP-galactopyranose and UDP

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27 July 2018

X-ray crystallography reveals a reduced substrate complex of UDP-galactopyranose mutase poised for covalent catalysis by flavin

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Ligand Binding and Substrate Discrimination by UDP-Galactopyranose Mutase

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27 July 2018

Contribution of galactofuranose to the virulence of the opportunistic pathogen Aspergillus fumigatus

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Investigation of binding of UDP-Galf and UDP-[3-F]Galf to UDP-galactopyranose mutase by STD-NMR spectroscopy, molecular dynamics, and CORCEMA-ST calculations

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A novel screening method for cell wall mutants in Aspergillus niger identifies UDP-galactopyranose mutase as an important protein in fungal cell wall biosynthesis

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The conformational free energy landscape of beta-D-glucopyranose. Implications for substrate preactivation in beta-glucoside hydrolases

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Eukaryotic UDP-galactopyranose mutase (GLF gene) in microbial and metazoal pathogens

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Crystal structures of Mycobacteria tuberculosis and Klebsiella pneumoniae UDP-galactopyranose mutase in the oxidised state and Klebsiella pneumoniae UDP-galactopyranose mutase in the (active) reduced state

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A unique catalytic mechanism for UDP-galactopyranose mutase

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Galactofuranose metabolism: a potential target for antimicrobial chemotherapy

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10.1371/JOURNAL.PONE.0109559

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Europe PubMed Central

PMC publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25299056 AND SRC:MED&resulttype=core&format=json

5 June 2020

2014PLoSO...9j9559P

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Europe PubMed Central

PMC publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25299056 AND SRC:MED&resulttype=core&format=json

5 June 2020

PubMed publication ID

1 reference

Europe PubMed Central

PMC publication ID

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5 June 2020

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