4PUE
Extracellulr Xylanase from Geobacillus stearothermophilus: E159Q mutant, with xylotetraose in active site
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2013-09-10 |
Detector | RIGAKU RAXIS HTC |
Wavelength(s) | 1.54 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 122.403, 61.976, 89.486 |
Unit cell angles | 90.00, 119.43, 90.00 |
Refinement procedure
Resolution | 36.470 - 2.200 |
R-factor | 0.17413 |
Rwork | 0.172 |
R-free | 0.21384 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1r86 |
RMSD bond length | 0.019 |
RMSD bond angle | 2.088 |
Data reduction software | HKL-3000 |
Data scaling software | SCALA |
Phasing software | REFMAC (5.7.0032) |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.260 |
High resolution limit [Å] | 2.200 | 2.203 |
Number of reflections | 27073 | |
Completeness [%] | 96.0 | 89.31 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.7 | 293 | 16% PEG 4000, 0.1M MES, 10mM Zinc chloride, pH 6.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |