Chiral induced spin selectivity
Since the initial landmark study on the chiral induced spin selectivity (CISS) effect in 1999,
considerable experimental and theoretical efforts have been made to understand the …
considerable experimental and theoretical efforts have been made to understand the …
The ensemble nature of allostery
Allostery is the process by which biological macromolecules (mostly proteins) transmit the
effect of binding at one site to another, often distal, functional site, allowing for regulation of …
effect of binding at one site to another, often distal, functional site, allowing for regulation of …
DynamicBind: Predicting ligand-specific protein-ligand complex structure with a deep equivariant generative model
While significant advances have been made in predicting static protein structures, the
inherent dynamics of proteins, modulated by ligands, are crucial for understanding protein …
inherent dynamics of proteins, modulated by ligands, are crucial for understanding protein …
Revealing enzyme functional architecture via high-throughput microfluidic enzyme kinetics
INTRODUCTION Enzymes possess extraordinary catalytic proficiency and specificity. These
properties ultimately derive from interactions not just between the active-site residues and …
properties ultimately derive from interactions not just between the active-site residues and …
Allostery in its many disguises: from theory to applications
Allosteric regulation plays an important role in many biological processes, such as signal
transduction, transcriptional regulation, and metabolism. Allostery is rooted in the …
transduction, transcriptional regulation, and metabolism. Allostery is rooted in the …
[HTML][HTML] Allostery in disease and in drug discovery
R Nussinov, CJ Tsai - Cell, 2013 - cell.com
Allostery is largely associated with conformational and functional transitions in individual
proteins. This concept can be extended to consider the impact of conformational …
proteins. This concept can be extended to consider the impact of conformational …
Protein allostery and conformational dynamics
The functions of many proteins are regulated through allostery, whereby effector binding at a
distal site changes the functional activity (eg, substrate binding affinity or catalytic efficiency) …
distal site changes the functional activity (eg, substrate binding affinity or catalytic efficiency) …
Protein ensembles: how does nature harness thermodynamic fluctuations for life? The diverse functional roles of conformational ensembles in the cell
All soluble proteins populate conformational ensembles that together constitute the native
state. Their fluctuations in water are intrinsic thermodynamic phenomena, and the …
state. Their fluctuations in water are intrinsic thermodynamic phenomena, and the …
Structure, dynamics, assembly, and evolution of protein complexes
JA Marsh, SA Teichmann - Annual review of biochemistry, 2015 - annualreviews.org
The assembly of individual proteins into functional complexes is fundamental to nearly all
biological processes. In recent decades, many thousands of homomeric and heteromeric …
biological processes. In recent decades, many thousands of homomeric and heteromeric …
The role of dynamic conformational ensembles in biomolecular recognition
Molecular recognition is central to all biological processes. For the past 50 years,
Koshland's' induced fit'hypothesis has been the textbook explanation for molecular …
Koshland's' induced fit'hypothesis has been the textbook explanation for molecular …