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Reversing allosteric communication: From detecting allosteric sites to inducing and tuning targeted allosteric response [PDF]
PLoS Computational Biology, 2018 The omnipresence of allosteric regulation together with the fundamental role of structural dynamics in this phenomenon have initiated a great interest to the detection of regulatory exosites and design of corresponding effectors. However, despite a general consensus on the key role of dynamics most of the earlier efforts on the prediction of allosteric
Igor N Berezovsky +2 more
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Allostery: Allosteric Cancer Drivers and Innovative Allosteric Drugs
Journal of Molecular Biology, 2022 Here, we discuss the principles of allosteric activating mutations, propagation downstream of the signals that they prompt, and allosteric drugs, with examples from the Ras signaling network. We focus on Abl kinase where mutations shift the landscape toward the active, imatinib binding-incompetent conformation, likely resulting in the high affinity ATP
Yonglan Liu +2 more
exaly +3 more sources
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Accounts of Chemical Research, 2019
Allostery, or allosteric regulation, is the phenomenon in which protein functional activity is altered by the binding of an effector at an allosteric site that is topographically distinct from the orthosteric, active site. As one of the most direct and efficient ways to regulate protein function, allostery has played a fundamental role in innumerable ...
Shaoyong Lu, Qiancheng Shen, Jian Zhang
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Allostery, or allosteric regulation, is the phenomenon in which protein functional activity is altered by the binding of an effector at an allosteric site that is topographically distinct from the orthosteric, active site. As one of the most direct and efficient ways to regulate protein function, allostery has played a fundamental role in innumerable ...
Shaoyong Lu, Qiancheng Shen, Jian Zhang
openaire +2 more sources
Olfaction: Allosteric modulation
Current Biology, 2023New research indicates that the odor-evoked responses of human olfactory receptors can be enhanced via the non-competitive binding of an allosteric modulator. This modulatory mechanism adds an additional layer of complexity to the peripheral encoding of odors.
Samuel, Caton, Adam, Dewan
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Allosteric Regulation of Proteases
ChemBioChem, 2008AbstractAllostery is a basic principle of control of enzymatic activities based on the interaction of a protein or small molecule at a site distinct from an enzyme's active center. Allosteric modulators represent an alternative approach to the design and synthesis of small‐molecule activators or inhibitors of proteases and are therefore of wide ...
Hauske, Patrick +4 more
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Computational elucidation of allosteric communication in proteins for allosteric drug design
Drug Discovery Today, 2022Allosteric modulators target topologically distal allosteric sites in order to modulate orthosteric sites, providing enhanced specificity and physiochemical properties. Harnessing allostery for drug discovery is an emerging paradigm in modern pharmaceutics.
Ren Kong, Shaoyong Lu, Duan Ni
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