Spontaneous Quaternary and Tertiary T-R Transitions of Human Hemoglobin in Molecular Dynamics Simulation
Figure 6
(A) Correlation between quaternary and tertiary transitions as averaged from six independent T→R transitions, and (B) correlation between subunits during T→R transitions. The correlation is measured using the mutual information (MI) between the projections on the respective difference vectors connecting the T and the R X-ray structures.