(Q36148800)

12 August 2017

Towards quantitative computer-aided studies of enzymatic enantioselectivity: the case of Candida antarctica lipase A. (English)

1 reference

12 August 2017

1 reference

0 references

Candida antarctica

1 reference

2

Arieh Warshel

1 reference

12 August 2017

1

Maria P Frushicheva

1 reference

12 August 2017

21 December 2011

1 reference

12 August 2017

1 reference

12 August 2017

13

1 reference

12 August 2017

2

1 reference

12 August 2017

215-223

1 reference

Revisiting the lipase from Pseudomonas aeruginosa: directed evolution of substrate acceptance and enantioselectivity using iterative saturation mutagenesis

12 August 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Enantioselectivity of haloalkane dehalogenases and its modulation by surface loop engineering

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Iterative saturation mutagenesis accelerates laboratory evolution of enzyme stereoselectivity: rigorous comparison with traditional methods.

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Absolute binding free energy calculations: on the accuracy of computational scoring of protein-ligand interactions

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Directed evolution of Candida antarctica lipase A using an episomaly replicating yeast plasmid

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

X-ray structure of Candida antarctica lipase A shows a novel lid structure and a likely mode of interfacial activation

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Electrostatic basis for enzyme catalysis

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Why does the Ras switch "break" by oncogenic mutations?

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Substrate entropy in enzyme enantioselectivity: an experimental and molecular modeling study of a lipase

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Enantioselectivity in Candida antarctica lipase B: a molecular dynamics study

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Enzymes work by solvation substitution rather than by desolvation

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

How do serine proteases really work?

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Examining methods for calculations of binding free energies: LRA, LIE, PDLD-LRA, and PDLD/S-LRA calculations of ligands binding to an HIV protease

2 October 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Calculations of antibody-antigen interactions: microscopic and semi-microscopic evaluation of the free energies of binding of phosphorylcholine analogs to McPC603

2 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Creating space for large secondary alcohols by rational redesign of Candida antarctica lipase B.

2 July 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

An S-selective lipase was created by rational redesign and the enantioselectivity increased with temperature.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

A water molecule in the stereospecificity pocket of Candida antarctica lipase B enhances enantioselectivity towards pentan-2-ol.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Influence of delta-functional groups on the enantiorecognition of secondary alcohols by Candida antarctica lipase B.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Direct epoxidation in Candida antarctica lipase B studied by experiment and theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Catalytic mechanism of limonene epoxide hydrolase, a theoretical study.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Learning from directed evolution: theoretical investigations into cooperative mutations in lipase enantioselectivity

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Predicting drug-resistant mutations of HIV protease

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Electrostatic contributions to protein-protein binding affinities: application to Rap/Raf interaction

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

A fast estimate of electrostatic group contributions to the free energy of protein-inhibitor binding.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Multiscale simulations of protein landscapes: using coarse-grained models as reference potentials to full explicit models

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2FCBIC.201100600

Directed evolution of an enantioselective lipase with broad substrate scope for hydrolysis of alpha-substituted esters

21 January 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Kinetics of acyl transfer reactions in organic media catalysed by Candida antarctica lipase B

21 October 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3414264

Semiquantitative calculations of catalytic free energies in genetically modified enzymes

21 October 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22190449

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Industrial methods for the production of optically active intermediates

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22190449

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Enantioselectivity of Haloalkane Dehalogenases and its Modulation by Surface Loop Engineering

1 reference

11 October 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/CBIC.201100600

Simulation of enzyme reactions using valence bond force fields and other hybrid quantum/classical approaches

1 reference

11 October 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/CBIC.201100600

Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function

1 reference

11 October 2022

https://opencitations.net/index/coci/api/v1/references/10.1002/CBIC.201100600

Identifiers

DOI

10.1002/CBIC.201100600

1 reference

release_2wsy55oxzrbq5cvf5lvsj4ukoe

12 August 2017

1 reference

Fatcat

https://api.fatcat.wiki/v0/release/2wsy55oxzrbq5cvf5lvsj4ukoe

mapped directly with Wikidata item

24 November 2022

based on heuristic

PMCID

3414264

1 reference

12 August 2017

1 reference

PMCID

3414264