Figure 3 - full size

Figure 3.
Fig. 3. Mobility, surface properties, and shape. (A) C trace of NOS[ox] 114 (cubic crystal form) colored by the crystallographic^ temperature factor (low to high B factors colored blue to red) and displayed with heme and mutation sites that affect function. Mutation sites (side chains displayed and labeled by residue number) affecting dimerization, L-Arg binding, or H[4]B binding (defined^ in Fig. 2) cluster to highly mobile (red) projecting regions. The view is rotated by about 45° from Fig. 1 about a vertical axis. (B) Solvent-accessible molecular surface of flattened^ (left) and concave (center) face. The orientation is the same^ as in (A). The exposed heme edge (gold), residues contributing to the distal pocket (cyan), and exposed conserved hydrophobic^ residues (green) (defined in Fig. 2) map to the same flattened^ face of the molecule and cluster in the regions of high mobility and mutational sensitivity shown in (A), making this surface the^ prime candidate for a symmetric dimer interface. (C) Solvent-accessible^ molecular surface of the narrow curved face. This face has few conserved exposed hydrophobic residues. The view is rotated 90° from (A) and (B) around a vertical axis.