1K5P
Hydrolytic haloalkane dehalogenase LINB from sphingomonas paucimobilis UT26 at 1.8A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-12-14 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.286, 68.369, 80.746 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.770 - 1.800 |
R-factor | 0.166 |
Rwork | 0.166 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1cv2 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.700 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.770 | 1.980 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.077 | 0.280 |
Number of reflections | 21294 | |
<I/σ(I)> | 10.6 | 2.2 |
Completeness [%] | 83.7 | 60.3 |
Redundancy | 12 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | PEG 4000, TRIS, magnesium chloride, VAPOR DIFFUSION, SITTING DROP, temperature 298K |