Jp. Xiong et al., CRYSTAL-STRUCTURE OF THE COMPLEX OF TRICHOSANTHIN WITH NADPH AT 0.172NM RESOLUTION, Chinese journal of chemistry, 15(3), 1997, pp. 265-277
The orthorhombic crystal structure of the complex of trichosanthin wit
h nicotinamide adenine dinucleotide phosphate has been determined by m
olecular replacement method using one of the molecules of the monoclin
ic crystal structure of trichosanthin at 0.27 nm resolution as the sea
rch model. The crystallographic refinement at 0.172 nm resolution led
to a final R-factor of 17.4% with root-mean-square deviations of 0.001
3 nm and 3.8 degrees from the ideal bond lengths and bond angles, resp
ectively. The quality of the structure, the polypeptide chain fold and
the comparison of it with that of the monoclinic trichosanthin struct
ure, the location of nicotinamide adenine dinucleotide phosphate, the
active site structure as well as the solvent structure are described.