2DD4
Thiocyanate hydrolase (SCNase) from Thiobacillus thioparus recombinant apo-enzyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-18B |
Synchrotron site | Photon Factory |
Beamline | BL-18B |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2004-11-10 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 170.307, 175.602, 114.791 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.950 - 2.060 |
R-factor | 0.165 |
Rwork | 0.165 |
R-free | 0.19300 |
Structure solution method | MAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.400 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 213749 | |
Completeness [%] | 96.3 | 91 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 1.5M Na/K Tartrate, 0.1M Potassium phosphate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 1.5M Na/K Tartrate, 0.1M Potassium phosphate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |