6DWV
Crystal structure of the LigJ Hydratase in the Apo state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | Cu FINE FOCUS |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-11-16 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 82.170, 78.220, 135.690 |
Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
Resolution | 26.140 - 2.200 |
R-factor | 0.2082 |
Rwork | 0.204 |
R-free | 0.27810 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.113 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.140 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 83173 | |
<I/σ(I)> | 12.3 | |
Completeness [%] | 96.0 | |
Redundancy | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 291 | 0.1 M sodium malonate 12% (w/v) polyethyleneglycol 3350 |