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ATP–Magnesium Coordination: Protein Structure-Based Force Field Evaluation and Corrections
[Image: see text] In the numerous molecular recognition and catalytic processes across biochemistry involving adenosine triphosphate (ATP), the common bioactive form is its magnesium chelate, ATP·Mg(2+). In aqueous solution, two chelation geometries predominate, distinguished by bidentate and triden...
Autores principales: | Buelens, Floris P., Leonov, Hadas, de Groot, Bert L., Grubmüller, Helmut |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8023659/ https://www.ncbi.nlm.nih.gov/pubmed/33616388 http://dx.doi.org/10.1021/acs.jctc.0c01205 |
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