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Enzyme kinetics / Protein structure / Proteins / Computational chemistry / Allosteric regulation / Molecular dynamics / Force field / Protein folding / Cooperativity / Chemistry / Biology / Molecular modelling


Supporting Information Weinkam et al[removed]pnas[removed]SI Materials and Methods Constructing the Allostery Model. For a given protein, the allostery model defines several effector bound and unbound landscapes that
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Document Date: 2014-08-23 13:21:27


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Company

IBM / Ligand / /

IndustryTerm

effector binding site / bonded energy term / potential energy function / allosteric site / energy function / energy landscape / energy plot / energy minima / average energy / softsphere energy / distance energy / simulation protocol / free energy profile / protein structure-prediction schemes using energy landscape theory / soft-sphere energy term / contact energy / funneled energy landscape / energy / weighted using the energy / /

Position

RT / δE∕RT / representative / Eastwood MP / /

Technology

simulation protocol / spectroscopy / RAM / X-ray / Thermodynamics / simulation / /

URL

www.pnas.org/cgi/doi/10.1073/pnas.1116274109 / /

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