Shobhit S. Chaturvedi

发表

Role of Structural Dynamics in Selectivity and Mechanism of Non-heme Fe(II) and 2-Oxoglutarate-Dependent Oxygenases Involved in DNA Repair

N. Lehnert, Tatyana G. Karabencheva-Christova, C. Schofield, 2020, ACS central science.

Can Second Coordination Sphere and Long-Range Interactions Modulate Hydrogen Atom Transfer in a Non-Heme Fe(II)-Dependent Histone Demethylase?

Tatyana G. Karabencheva-Christova, C. Schofield, C. Christov, 2022, JACS Au.

Structure-function relationships in KDM7 histone demethylases.

Tatyana G. Karabencheva-Christova, C. Christov, Rajeev Ramanan, 2019, Advances in protein chemistry and structural biology.

Conformational Dynamics Underlies Different Functions of Human KDM7 Histone Demethylases.

C. Schofield, C. Christov, Rajeev Ramanan, 2019, Chemistry.

How Human TET2 Enzyme Catalyzes the Oxidation of Unnatural Cytosine Modifications in Double-Stranded DNA.

C. Christov, Sodiq O. Waheed, Shobhit S. Chaturvedi, 2022, ACS catalysis.

Catalytic Mechanism of Human Ten-Eleven Translocation-2 (TET2) Enzyme: Effects of Conformational Changes, Electric Field, and Mutations

C. Christov, Sodiq O. Waheed, Shobhit S. Chaturvedi, 2021 .

A synergy between the catalytic and structural Zn(II) ions and the enzyme and substrate dynamics underlies the structure–function relationships of matrix metalloproteinase collagenolysis

G. Fields, Shobhit S. Chaturvedi, A. Varghese, 2021, JBIC Journal of Biological Inorganic Chemistry.

Atomic and Electronic Structure Determinants Distinguish between Ethylene Formation and l-Arginine Hydroxylation Reaction Mechanisms in the Ethylene-Forming Enzyme

R. Hausinger, C. Christov, Rajeev Ramanan, 2021 .

Conformational flexibility influences structure-function relationships in nucleic acid N-methyl demethylases.

C. Schofield, C. Christov, Rajeev Ramanan, 2019, Organic & biomolecular chemistry.

Catalysis by the JmjC histone demethylase KDM4A integrates substrate dynamics, correlated motions and molecular orbital control†

N. Lehnert, C. Schofield, C. Christov, 2020, Chemical science.

Catalysis by the Non-Heme Iron(II) Histone Demethylase PHF8 Involves Iron Center Rearrangement and Conformational Modulation of Substrate Orientation

N. Lehnert, C. Schofield, C. Christov, 2019, ACS catalysis.

Effects of the Nature of the Metal Ion, Protein and Substrate on the Catalytic Center in Matrix Metalloproteinase-1: Insights from Multilevel MD, QM/MM and QM Studies.

G. Fields, Shobhit S. Chaturvedi, A. Varghese, 2021, Chemphyschem : a European journal of chemical physics and physical chemistry.

From random to rational: improving enzyme design through electric fields, second coordination sphere interactions, and conformational dynamics

A. Alexandrova, Shobhit S. Chaturvedi, Daniel Bím, 2023, Chemical science.

Directed Evolution of Protoglobin Optimizes the Enzyme Electric Field.

A. Alexandrova, Shobhit S. Chaturvedi, Santiago Vargas, 2024, Journal of the American Chemical Society.