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Figure 5.
Figure 5. Molecular Dynamics of the Conformational Change
of GeldanamycinSuperimposition of averaged structures collected
during the 800 ps TMD simulation that converts the free into the
bound form of geldanamycin. In the superimpositions, the initial
structures are colored in yellow, and the final structures are
colored in cyan. The intermediate conformations are explicitly
shown. For clarity, only the polar hydrogens are shown.
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