2HRW
Crystal Structure of Phosphonopyruvate Hydrolase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-BM |
Synchrotron site | APS |
Beamline | 17-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-06-28 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.0 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 74.880, 79.020, 93.440 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.620 - 2.200 |
R-factor | 0.21 |
Rwork | 0.204 |
R-free | 0.27100 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.021 |
RMSD bond angle | 1.970 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.620 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.080 | 0.656 |
Number of reflections | 13871 | |
<I/σ(I)> | 13.2 | |
Completeness [%] | 95.0 | 96.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 2.3M xylose, 100 mM HEPES, pH7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |