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The rational development of specific inhibitors for the ~500 protein kinases encoded in the human genome is impeded by a poor understanding of the structural basis for the activity and selectivity of small molecules that compete for ATP…

Intrinsically disordered proteins (IDPs) and proteins with intrinsically disordered regions (IDRs) govern a daunting number of physiological processes. For such proteins, molecular mechanisms governing their interactions with proteins…

生物大分子 · 定量生物学 2016-11-15 Erik C. Cook , Bin Sun , Peter M. Kekenes-Huskey , Trevor P Creamer

Adhesion between a T cell and an antigen presenting cell is achieved by TCR-pMHC and LFA1-ICAM1 protein complexes. These segregate to form a special pattern, known as the immunological synapse (IS), consisting of a central quasi-circular…

软凝聚态物质 · 物理学 2017-10-06 Nadiv Dharan , Oded Farago

Intrinsically disordered proteins (IDPs) constitute a broad set of proteins with few uniting and many diverging properties. IDPs-and intrinsically disordered regions (IDRs) interspersed between folded domains-are generally characterized as…

生物大分子 · 定量生物学 2021-06-03 Kresten Lindorff-Larsen , Birthe B. Kragelund

Through experimental studies, many details of the pathway of integrin $\alpha_{\rm IIb}\beta_3$ activation by ADP during the platelet aggregation process have been mapped out. ADP binds to two separate G protein coupled receptors on…

分子网络 · 定量生物学 2025-03-26 Keshav B. Patel , Wolfgang Bergmeier , Aaron L. Fogelson

Intrinsically disordered proteins (IDPs) do not possess well-defined three-dimensional structures in solution under physiological conditions. We develop all-atom, united-atom, and coarse-grained Langevin dynamics simulations for the IDP…

An intrinsically disordered protein (IDP) lacks a stable three-dimensional structure, while it folds into a specific structure when it binds to a target molecule. In some IDP-target complexes, not all target binding surfaces are exposed on…

生物大分子 · 定量生物学 2013-12-12 Nobu C. Shirai , Macoto Kikuchi

The mechanical response of intrinsically disordered proteins (IDPs) and polyampholyte (PA) chains is vital for understanding their biological functions and designing functional materials. We investigate the force-extension behavior of a PA…

软凝聚态物质 · 物理学 2025-11-14 Rakesh Palariya , Sunil P. Singh

Intrinsically disordered proteins (IDPs) are important for biological functions. In contrast to folded proteins, molecular recognition among certain IDPs is "fuzzy" in that their binding and/or phase separation are stochastically governed…

生物大分子 · 定量生物学 2020-08-10 Alan N. Amin , Yi-Hsuan Lin , Suman Das , Hue Sun Chan

The intrinsic dynamics of most proteins are central to their function. Protein tyrosine kinases such as Abl1 undergo significant conformational changes that modulate their activity in response to different stimuli. These conformational…

生物物理 · 物理学 2025-08-12 Gabriel Monteiro da Silva , Kyle Lam , David C. Dalgarno , Brenda M. Rubenstein

By embedding inert tracer particles (TPs) in a growing multicellular spheroid the local stresses on the cancer cells (CCs) can be measured. In order for this technique to be effective the unknown effect of the dynamics of the TPs on the CCs…

生物物理 · 物理学 2020-10-20 Himadri S. Samanta , Sumit Sinha , D. Thirumalai

The determination of a 'folding core' can help to provide insight into the structure, flexibility, mobility and dynamics, and hence, ultimately, function of a protein - a central concern of structural biology. Changes in the folding core…

生物大分子 · 定量生物学 2015-04-09 J. W. Heal , R. A. Römer , C. A. Blindauer , R. B. Freedman

Nonequilibrium dynamics of biomembranes with active inclusions is considered. The inclusions represent protein molecules which perform cyclic internal conformational motions driven by the energy brought with ATP ligands. As protein…

软凝聚态物质 · 物理学 2015-05-13 Hsuan-Yi Chen , Alexander S. Mikhailov

A new approach to the modular, complex systems analysis of nonlinear dynamics in cell cycling network transformations involved in carcinogenesis is proposed. Carcinogenesis is a complex process that involves dynamically inter-connected…

分子网络 · 定量生物学 2007-05-23 V. I. Prisecaru , I. C. Baianu

We study the regulating mechanism of p53 on the properties of cell cycle dynamics in the light of the proposed model of interacting p53 and cell cycle networks via p53. Irradiation (IR) introduce to p53 compel p53 dynamics to suffer…

分子网络 · 定量生物学 2014-10-14 Md. Jahoor Alam , Sanjay Kumar , Vikram Singh , R. K. Brojen Singh

In 1999 Wright and Dyson highlighted the fact that large sections of the proteome of all organisms are comprised of protein sequences that lack globular folded structures under physiological conditions. Since then the biophysics community…

生物物理 · 物理学 2024-09-05 Zi Hao Liu , Maria Tsanai , Oufan Zhang , Julie Forman-Kay , Teresa Head-Gordon

Cell crawling requires the generation of intracellular forces by the cytoskeleton and their transmission to an extracellular substrate through specific adhesion molecules. Crawling cells show many features of excitable systems, such as…

生物物理 · 物理学 2020-06-02 Pierre Sens

Lck (lymphocyte-specific protein tyrosine kinase) is an enzyme which plays a number of important roles in the function of immune cells. It belongs to the Src family of kinases which are known to undergo autophosphorylation. It turns out…

分子网络 · 定量生物学 2021-01-26 Lisa Maria Kreusser , Alan D. Rendall

The biological processes that execute complex multiple functions, such as cell cycle, must ensure the order of sequential events and keep the dynamic robustness against various fluctuations. Here, we examine the dynamic mechanism and the…

分子网络 · 定量生物学 2020-04-22 Yao Zhao , Dedi Wang , Zhiwen Zhang , Ying Lu , Xiaojing Yang , Qi Ouyang , Chao Tang , Fangting Li

In many organisms, cell division is driven by the constriction of a cytokinetic ring, which consists of actin filaments and crosslinking proteins. While it has long been believed that the constriction is driven by motor proteins, it has…

生物物理 · 物理学 2023-07-26 Alexander Cumberworth , Pieter Rein ten Wolde
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