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Modeling and docking studies of Chromate reductase from Bacillus subtilis ANUES03 with Degradation of Hexavalent Chromium
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| Author:
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GUNTI.VIJAY KUMAR, PANDU. BRAHMAJI RAO
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| Abstract:
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Hexavalent chromium is versatile, highly dangerous and ecologically toxic. Chromate reductases, found in chromium safe microscopic organisms are known to catalyze the decrease of Cr (VI) to Cr (III) and have as of late got specific consideration for their likely use in bioremediation measure. Using 1ZCH as a design with modeler7v7, a three-dimensional model of Bacillus subtilis Chromate reductase was created. Procheck and 3D map regulated models with the guide to sub-atomic dynamics and complex techniques. The 3D structure of chromate reductase was contrasted and formatted, and last models were acquired following the minimization of vitality and the strategy of sub-atomic mechanics and sub-atomic components. Adaptable docking investigations have been conducted using a strongly communicated Chromate Reductase and hexavalent chromium. The findings show that in chromate reductase MET66, ILE70, PHE75 in Bacillus subtilis ANUES03 are major contributors to cycle restriction as they carry solid hydrogen in these blending systems. These interactions with hydrogen keeping play an important role in the stabilization of the complex.
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| Keyword:
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Chromate reductase; Modeling; Molecular dynamics; Hexavalent chromium; docking studies; Degradation
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| EOI:
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-
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| DOI:
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https://doi.org/10.31838/ijpr/2020.SP2.359
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| Download:
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