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Fig. 1 | Journal of Cheminformatics

Fig. 1

From: Machine learning approaches to optimize small-molecule inhibitors for RNA targeting

Fig. 1

The complete structure of the Mycobacterium smegmatis 70S ribosome (PDBid: 5O61 [21]). Hairpin 91 used as a target for the design of small molecule inhibitors (purple) is part of the peptidyl transferase center. This hairpin is the RNA target that was used for the initial NMR fragment screening that yielded 2-phenylthiazole and for docking of 2-phenylthiazole containing drug-sized molecules

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