A modular treatment of molecular traffic through the active site of cholinesterase (Q40152460)

18 September 2017

A modular treatment of molecular traffic through the active site of cholinesterase (English)

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18 September 2017

Botti SA

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18 September 2017

Felder CE

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18 September 2017

Lifson S

3

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18 September 2017

Sussman JL

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18 September 2017

Silman I

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18 September 2017

language of work or name

English

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publication date

1 November 1999

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18 September 2017

21

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inferred from page(s)

published in

Biophysical Journal

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18 September 2017

77

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18 September 2017

5

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18 September 2017

2430-2450

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"Back door" opening implied by the crystal structure of a carbamoylated acetylcholinesterase

18 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Conformation gating as a mechanism for enzyme specificity

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

The alpha/beta fold family of proteins database and the cholinesterase gene server ESTHER

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Crystal structure of an acetylcholinesterase-fasciculin complex: interaction of a three-fingered toxin from snake venom with its target

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

ProMod and Swiss-Model: Internet-based tools for automated comparative protein modelling

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Cloning and sequencing of a cDNA encoding acetylcholinesterase in Colorado potato beetle, Leptinotarsa decemlineata (Say).

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Cation-pi interactions in chemistry and biology: a new view of benzene, Phe, Tyr, and Trp

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase inhibition by fasciculin: crystal structure of the complex

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

An electrostatic mechanism for substrate guidance down the aromatic gorge of acetylcholinesterase

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Quaternary ligand binding to aromatic residues in the active-site gorge of acetylcholinesterase

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Dissection of the human acetylcholinesterase active center determinants of substrate specificity. Identification of residues constituting the anionic site, the hydrophobic site, and the acyl pocket

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Molecular and cellular biology of cholinesterases

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

The cholinesterases: from genes to proteins

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Classical electrostatics in biology and chemistry

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase: diffusional encounter rate constants for dumbbell models of ligand

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Electrostatic and hydrodynamic orientational steering effects in enzyme-substrate association

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Cloning, sequencing and functional expression of an acetylcholinesterase gene from the yellow fever mosquito Aedes aegypti.

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Fasciculins, anticholinesterase toxins from the venom of the green mamba Dendroaspis angusticeps.

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Fractional diffusion-limited component of reactions catalyzed by acetylcholinesterase

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Calculation of the total electrostatic energy of a macromolecular system: solvation energies, binding energies, and conformational analysis

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Comparison of butyrylcholinesterase and acetylcholinesterase

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Insect acetylcholinesterase: catalytic properties, tissue distribution and molecular forms

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholine binding by a synthetic receptor: implications for biological recognition

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Basic local alignment search tool

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Atomic Structure of Acetylcholinesterase from Torpedo californica : A Prototypic Acetylcholine-Binding Protein

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Substrate inhibition of acetylcholinesterase: residues affecting signal transduction from the surface to the catalytic center

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Interaction of fluorescence probes with acetylcholinesterase. Site and specificity of propidium binding

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Interaction of ligands with acetylcholinesterase. Use of temperature-jump relaxation kinetics in the binding of specific fluorescent ligands

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Catalysis by acetylcholinesterase: evidence that the rate-limiting step for acylation with certain substrates precedes general acid-base catalysis

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Electrostatic attraction by surface charge does not contribute to the catalytic efficiency of acetylcholinesterase

22 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Aspartate 74 as a primary determinant in acetylcholinesterase governing specificity to cationic organophosphonates

25 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Allosteric control of acetylcholinesterase catalysis by fasciculin

25 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Studies on cholinesterase: 1. Cholinesterase and pseudo-cholinesterase

25 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Electrostatic influence on the kinetics of ligand binding to acetylcholinesterase. Distinctions between active center ligands and fasciculin

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase: role of the enzyme's charge distribution in steering charged ligands toward the active site

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Site-directed mutants designed to test back-door hypotheses of acetylcholinesterase function.

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Three distinct domains in the cholinesterase molecule confer selectivity for acetyl- and butyrylcholinesterase inhibitors

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

The effect of acetylcholinesterase on outgrowth of dopaminergic neurons in organotypic slice culture of rat mid-brain.

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Allosteric modulation of acetylcholinesterase activity by peripheral ligands involves a conformational transition of the anionic subsite.

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase: evidence that sodium ion binding at the anionic site causes inhibition of the second-order hydrolysis of acetylcholine and a decrease of its pKa as well as of deacetylation

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Cationic and uncharged substrates and reversible inhibitors in hydrolysis by acetylcholinesterase (EC 3.1.1.7). The trimethyl subsite

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Activation of acetylcholinesterase by monovalent (Na+,K+) and divalent (Ca2+,Mg2+) cations.

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Inorganic ion effects on the kinetic parameters of acetylcholinesterase

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Inhibition kinetics of acetylcholinesterase with fluoromethyl ketones

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Role of the peripheral anionic site on acetylcholinesterase: inhibition by substrates and coumarin derivatives

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Catalytic properties of cholinesterases: importance of tyrosine 109 in Drosophila protein

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

A mechanistic model for butyrylcholinesterase

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

15 June 2018

Acetylcholinesterase.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

External and internal electrostatic potentials of cholinesterase models.

15 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Existence of four acetylcholinesterase genes in the nematodes Caenorhabditis elegans and Caenorhabditis briggsae.

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Electrooptical measurements demonstrate a large permanent dipole moment associated with acetylcholinesterase

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Evidence for a Zn(2+)-binding site in human serum butyrylcholinesterase

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase accelerates assembly of amyloid-beta-peptides into Alzheimer's fibrils: possible role of the peripheral site of the enzyme.

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Acetylcholinesterase: electrostatic steering increases the rate of ligand binding.

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Open "back door" in a molecular dynamics simulation of acetylcholinesterase.

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Simulation of charge-mutant acetylcholinesterases

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Effective charge on acetylcholinesterase active sites determined from the ionic strength dependence of association rate constants with cationic ligands.

20 August 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1300520

Inhibition of pig liver esterase by trifluoromethyl ketones: modulators of the catalytic reaction alter inhibition kinetics

20 August 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Influence of acetylcholinesterase on embryonic spinal rat motoneurones growth in culture: a quantitative morphometric study

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

The inhibitory effect of stilbamidine, curare and related compounds and its relationship to the active groups of acetylcholine esterase; action of stilbamidine upon nerve impulse conduction

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

pH dependence of the inhibition of chymotrypsin by a peptidyl trifluoromethyl ketone

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

The X-ray Structure of a Transition State Analog Complex Reveals the Molecular Origins of the Catalytic Power and Substrate Specificity of Acetylcholinesterase

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Kinetics of acetylthiocholine binding to electric eel acetylcholinesterase in glycerol/water solvents of increased viscosity. Evidence for a diffusion-controlled reaction

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Inhibition of serine proteases by peptidyl fluoromethyl ketones

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Contribution of long-range electrostatic interactions to the stabilization of the catalytic transition state of the serine protease subtilisin BPN'

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

The mechanism of action of acetylcholinesterase: substrate inhibition and the binding of inhibitors

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Cholinesterases regulate neurite growth of chick nerve cells in vitro by means of a non-enzymatic mechanism

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Asp7O in the peripheral anionic site of human butyrylcholinesterase

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Role of aspartate 70 and tryptophan 82 in binding of succinyldithiocholine to human butyrylcholinesterase

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Molecular recognition in acetylcholinesterase catalysis: free-energy correlations for substrate turnover and inhibition by trifluoro ketone transition-state analogs

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

The architecture of human acetylcholinesterase active center probed by interactions with selected organophosphate inhibitors

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Acetylcholinesterase: enzyme structure, reaction dynamics, and virtual transition states

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Acetylcholinesterase promotes regeneration of neurites in cultured adult neurons of Aplysia

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Electrostatic potential of the acetylcholine binding sites in the nicotinic receptor probed by reactions of binding-site cysteines with charged methanethiosulfonates

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

X-ray diffraction analysis of the inhibition of porcine pancreatic elastase by a peptidyl trifluoromethylketone

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Amino acid residues controlling acetylcholinesterase and butyrylcholinesterase specificity

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Calculation of the electric potential in the active site cleft due to alpha-helix dipoles

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

A 240-Fold Electrostatic Rate-Enhancement for Acetylcholinesterase−Substrate Binding Can Be Predicted by the Potential within the Active Site

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0006-3495%2899%2977080-3

Responses of acetylcholinesterase from Torpedo marmorata to salts and curarizing drugs

7 January 2021

1 reference

12 December 2020

Studies on cholinesterase. VII. The active surface of acetylcholine esterase derived from effects of pH on inhibitors

1 reference

12 December 2020

Butyrylcholinesterase regulates laminar retinogenesis of the chick embryo in vitro

1 reference

12 December 2020

The "back door" hypothesis for product clearance in acetylcholinesterase challenged by site-directed mutagenesis

1 reference

12 December 2020

Acetylcholinesterase: reversible inhibitors, substrate inhibition

1 reference

12 December 2020

10.1016/S0006-3495(99)77080-3

Identifiers

DOI

1 reference

18 September 2017

1 reference

18 September 2017

1 reference