6C2C

The molecular basis for the functional evolution of an organophosphate hydrolysing enzyme

Refinement Statistics

Experimental method:X-RAY DIFFRACTION (1.597 Å)

Cell axes57.60088.150119.800
Cell angles90.0090.0090.00
SpacegroupP 21 21 21
Resolution limits26.38 - 1.60
the highest resolution shell value1.617 - 1.597
R-factor0.1746
R-work0.17310
the highest resolution shell value0.205
R-free0.20410
the highest resolution shell value0.263
RMSD bond length0.017
RMSD bond angle1.448

Data Collection Statistics

Resolution limits26.38 - 1.60
the highest resolution shell value -
Number of reflections78579
Rmerge_l_obs0.025
the highest resolution shell value0.126
Completeness96.3
Redundancy1.9
the highest resolution shell value1.9

Crystallization Conditions

crystal IDmethodpHpH rangetemperatureunit
1VAPOR DIFFUSION, SITTING DROP7.5291

Crystallization Reagents

IDcrystal IDsolution IDreagent nameconcentrationdetails
Crystallization Reagents in Literatures*
IDcrystal IDsolutionreagent nameconcentration (unit)details
Annotated Information is extracted from Literature Info*