Publications : Journal Article

Deep Mutagenesis of a Transporter for Uptake of a Non-Native Substrate Identifies Conformationally Dynamic Regions

bioRxiv, 2021
*Young, Heather J. and *Chan, Matthew and *Selvam, Balaji and Szymanski, Steven K. and Shukla, Diwakar and Procko, Erik
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Distinct Binding Mechanisms for Allosteric Sodium Ion In Cannabinoid Receptors

bioRxiv, 2021.
Dutta, Soumajit and Selvam, Balaji and Shukla, Diwakar
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Why does Δ9-Tetrahydrocannabinol act as a partial agonist of cannabinoid receptors?

bioRxiv, 2021.
Dutta, Soumajit and Selvam, Balaji and Das, Aditi and Shukla, Diwakar
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Activation Mechanism of Strigolactone Receptors And Its Impact On Ligand Selectivity Between Host And Parasitic Plants

bioRxiv, 2021.
Chen, Jiming and Nelson, David C. and Shukla, Diwakar
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Role of substrate recognition in modulating strigolactone receptor selectivity in witchweed

bioRxiv, 2021
Chen, Jiming and White, Alexandra and Nelson, David E. and Shukla, Diwakar
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How antiporters exchange substrates across the cell membrane? An atomic-level description of the complete exchange cycle in NarK

Structure, 2021
Feng, Jiangyan and Selvam, Balaji and Shukla, Diwakar
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Degradation of complex arabinoxylans by human colonic Bacteroidetes

Nature communications, 12(1): 1-21, 2021
Pereira, Gabriel V and Abdel-Hamid, Ahmed M and Dutta, Soumajit and D’Alessandro-Gabazza, Corina N and Wefers, Daniel and Farris, Jacob A and Bajaj, Shiv and Wawrzak, Zdzislaw and Atomi, Haruyuki and Mackie, Roderick I and Gabazza, Esteban C and Shukla, Diwakar and Koropatkin, Nicole M and Cann, Issac
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Structure and Potential-Dependent Selectivity in Redox-Metallopolymers: Electrochemically Mediated Multicomponent Metal Separations

Advanced Functional Materials, 2021
Chen, Raylin and Feng, Jiangyan and Jeon, Jemin and Sheehan, Thomas and Rüttiger, Christian and Gallei, Markus and Shukla, Diwakar and Su, Xiao
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Impact of increased membrane realism on conformational sampling of proteins

bioRxiv, 2021
Weigle, Austin T. and Carr, Matthew and Shukla, Diwakar
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Reconciling Membrane Protein Simulations with Experimental DEER Spectroscopy Data

bioRxiv, 2020
Mittal, Shriyaa and Shukla, Diwakar
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