Fig. 5 | Scientific Reports

Fig. 5

From: Molecular dynamics, docking and quantum calculations reveal conformational changes influenced by CYP271A amino acid mutations related to cerebrotendinous xanthomatosis

Fig. 5

Representative CYP27A1 conformations of the most populated cluster of WT and mutant proteins. (A) The native conformation (green) and the conformation retrieved from MPCC (cyan) are superimposed. The representative conformation of the WT of the most populated cluster (cyan) is superimposed with mutants (B) M1, (C) M2, (D) M3, (E) M4, (F) M5, (G) M6, and (H) M7, which are colored in cyan. Regions with major structural differences in the native conformation (A) or the conformation of the most populated cluster (B-H) are colored in red which is related to RMSF.

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