Figure 2 - full size

 

Figure 2.
Figure 2. Structure of SBD in complex with chitobiose. (a) Stereo view of the difference-density map (F[o] - F[c] with phase from the Fbs1 model) of binding chitobiose, contoured at 2.1 , modeled into the electron density. -strands belonging to S1 and S2 are blue and red, respectively. Loops are black. The bound chitobiose is orange, and the residues involved in the substrate binding (FYWK, see Fig. 1c) are green. (b) Molecular surface representation of the chitobiose-binding region. The bound chitobiose is shown in ball-and-stick representation. Two GlcNAc residues are represented by A and B. Cyan spheres are two water molecules of wild type SBD that are fixed on the molecular surface through hydrogen bonds with the backbone N and O of Lys281, respectively. These water molecules are replaced by O3 and O6 of the chitobiose upon formation of the SBD -chitobiose complex. (c) Stick representation of the amino acids involved in binding. Hydrogen bonds are dashed lines. Oxygen and nitrogen are red and blue, respectively. Symbols of two water molecules are as in b.

The above figure is reprinted by permission from Macmillan Publishers Ltd: Nat Struct Mol Biol (2004, 11, 365-370) copyright 2004.