(Q45402445)

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Exploring the Development of Ground-State Destabilization and Transition-State Stabilization in Two Directed Evolution Paths of Kemp Eliminases

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scholarly article

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Europe PubMed Central

PMC publication ID

14 December 2017

Exploring the Development of Ground-State Destabilization and Transition-State Stabilization in Two Directed Evolution Paths of Kemp Eliminases (English)

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Europe PubMed Central

PMC publication ID

14 December 2017

directed evolution

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4

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Arieh Warshel

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Europe PubMed Central

PMC publication ID

14 December 2017

author name string

Garima Jindal

1

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Europe PubMed Central

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14 December 2017

Balajee Ramachandran

2

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Europe PubMed Central

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14 December 2017

Ram Prasad Bora

3

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Europe PubMed Central

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14 December 2017

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publication date

30 March 2017

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Europe PubMed Central

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14 December 2017

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Europe PubMed Central

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14 December 2017

7

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Europe PubMed Central

PMC publication ID

14 December 2017

5

1 reference

Europe PubMed Central

PMC publication ID

14 December 2017

3301-3305

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Europe PubMed Central

PMC publication ID

14 December 2017

The role of side chain entropy and mutual information for improving the de novo design of Kemp eliminases KE07 and KE70.

1 reference

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The entropic contributions in vitamin B12 enzymes still reflect the electrostatic paradigm

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The EVB as a quantitative tool for formulating simulations and analyzing biological and chemical reactions

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Computer aided enzyme design and catalytic concepts

1 reference

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Precision is essential for efficient catalysis in an evolved Kemp eliminase

1 reference

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Computational design gains momentum in enzyme catalysis engineering

1 reference

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A Single Mutation in a Regulatory Protein Produces Evolvable Allosterically Regulated Catalyst of Nonnatural Reaction

1 reference

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Computational enzyme design

1 reference

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De novo enzymes by computational design

1 reference

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1 reference

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Iterative approach to computational enzyme design

1 reference

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Catalysis by dihydrofolate reductase and other enzymes arises from electrostatic preorganization, not conformational motions

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Design of a switchable eliminase

1 reference

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Challenges and advances in validating enzyme design proposals: the case of kemp eliminase catalysis

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Optimization of the In-Silico-Designed Kemp Eliminase KE70 by Computational Design and Directed Evolution

1 reference

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24 May 2018

Exploring challenges in rational enzyme design by simulating the catalysis in artificial kemp eliminase

1 reference

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Computational Design of an Enzyme Catalyst for a Stereoselective Bimolecular Diels-Alder Reaction

1 reference

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Ketosteroid isomerase provides further support for the idea that enzymes work by electrostatic preorganization

1 reference

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Evolutionary optimization of computationally designed enzymes: Kemp eliminases of the KE07 series

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The empirical valence bond as an effective strategy for computer-aided enzyme design

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Toward accurate screening in computer-aided enzyme design

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Origin of the activity drop with the E50D variant of catalytic antibody 34E4 for Kemp elimination

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Catalytic mechanism and performance of computationally designed enzymes for Kemp elimination

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Kemp elimination catalysts by computational enzyme design

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Modeling electrostatic effects in proteins

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Electrostatic basis for enzyme catalysis

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Identifiers

10.1021/ACSCATAL.7B00171

1 reference

Europe PubMed Central

PMC publication ID

14 December 2017

PMC publication ID

1 reference

Europe PubMed Central

PMC publication ID

14 December 2017

PubMed publication ID

1 reference

Europe PubMed Central

PMC publication ID

14 December 2017

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