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. 2017 Nov 30;12(11):e0188915. doi: 10.1371/journal.pone.0188915

Fig 3. Overlay of the ligand free structures of PgDPP III generated during MD simulations.

Fig 3

Overlay of the initial structure of PgDPP III (obtained by comparative modelling, redand the structure obtained after 200 ns of MD simulations (blue). The zinc ion is represented as a grey sphere.