Ab Initio QM/MM Free-Energy Studies of Arginine Deiminase Catalysis: The Protonation State of the Cys Nucleophile (Q34756946)

4 August 2017

title

Ab initio QM/MM free-energy studies of arginine deiminase catalysis: the protonation state of the Cys nucleophile (English)

1 reference

https://api.crossref.org/works/10.1021/JP200843S

4 August 2017

Ab Initio QM/MM Free-Energy Studies of Arginine Deiminase Catalysis: The Protonation State of the Cys Nucleophile (English)

1 reference

27 November 2024

Zhihong Ke

1 reference

4 August 2017

Hua Guo

1 reference

4 August 2017

Daiqian Xie

1 reference

4 August 2017

Shenglong Wang

1 reference

4 August 2017

Yingkai Zhang

1 reference

4 August 2017

language of work or name

English

0 references

publication date

11 March 2011

1 reference

full work available at URL

4 August 2017

https://europepmc.org/articles/pmc3070061?pdf=render

file format

Portable Document Format

online access status

open access

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A21395290

https://europepmc.org/articles/PMC3070061

27 November 2024

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A21395290

https://europepmc.org/articles/PMC3070061?pdf=render

27 November 2024

file format

Portable Document Format

online access status

open access

content deliverer

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A21395290

https://doi.org/10.1021/jp200843s

27 November 2024

online access status

open access

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?resulttype=core&format=json&query=SRC%3AMED%20AND%20EXT_ID%3A21395290

https://pubs.acs.org/doi/pdf/10.1021/jp200843s

27 November 2024

1 reference

https://api.crossref.org/works/10.1021/JP200843S

Journal of Physical Chemistry B

27 November 2024

published in

1 reference

4 August 2017

volume

115

1 reference

4 August 2017

1 reference

4 August 2017

page(s)

3725-3733

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3070061

4 August 2017

1 reference

Born-Oppenheimer ab initio QM/MM molecular dynamics simulations of the hydrolysis reaction catalyzed by protein arginine deiminase 4.

7 July 2018

1 reference

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Active site cysteine is protonated in the PAD4 Michaelis complex: evidence from Born-Oppenheimer ab initio QM/MM molecular dynamics simulations

7 July 2018

1 reference

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QM/MM methods for biomolecular systems

7 July 2018

1 reference

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1 reference

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How do SET-domain protein lysine methyltransferases achieve the methylation state specificity? Revisited by Ab initio QM/MM molecular dynamics simulations

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1 reference

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Protein arginine deiminase 4: evidence for a reverse protonation mechanism

7 July 2018

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Human PAD4 regulates histone arginine methylation levels via demethylimination

7 July 2018

1 reference

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7 July 2018

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PAD, a growing family of citrullinating enzymes: genes, features and involvement in disease

7 July 2018

1 reference

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1 reference

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7 July 2018

1 reference

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7 July 2018

1 reference

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Arginine deiminase inhibits proliferation of human leukemia cells more potently than asparaginase by inducing cell cycle arrest and apoptosis.

7 July 2018

1 reference

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7 July 2018

1 reference

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Identification of two human dimethylarginine dimethylaminohydrolases with distinct tissue distributions and homology with microbial arginine deiminases

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1 reference

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1 reference

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1 reference

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Identifiers

DOI

10.1021/JP200843S

1 reference

4 August 2017

1 reference

4 August 2017

1 reference