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Mutation Information
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Mutation Site
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I54M |
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Mutation Type
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Amino acid level |
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Gene/Protein/Region Type
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PR |
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Relevant Drug
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PIs |
Literature Information
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PubMed PMID
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27240358
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Published Year
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2016 |
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Journal
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International journal of molecular sciences |
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Title
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Computational Studies of a Mechanism for Binding and Drug Resistance in the Wild Type and Four Mutations of HIV-1 Protease with a GRL-0519 Inhibitor. |
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Author
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Hu G,Ma A,Dou X,Zhao L,Wang J |
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Evidence
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To elucidate the molecular mechanism of drug resistance associated with mutations (D30N, I50V, I54M, and V82A) and inhibitor (GRL-0519) complexes, we have performed five molecular dynamics (MD) simulations and calculated the binding free energies using the molecular mechanics Poisson-Boltzmann surface area (MM-PBSA) method.
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HIV Mutation Detail Information