3MUI
Enzyme-Substrate interactions of IXT6, the intracellular xylanase of G. stearothermophilus.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-12-05 |
Detector | ADSC QUANTUM 4r |
Wavelength(s) | 0.939 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 169.270, 79.859, 78.820 |
Unit cell angles | 90.00, 91.47, 90.00 |
Refinement procedure
Resolution | 19.970 - 1.800 |
Rwork | 0.195 |
R-free | 0.21300 |
Starting model (for MR) | 2q8x |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.970 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 91101 | |
<I/σ(I)> | 15.2 | 2.12 |
Completeness [%] | 93.9 | 81.9 |
Redundancy | 2.98 | 2.74 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1M sodium cacodylate pH 6.5, 1.9M soduim acetate, VAPOR DIFFUSION, HANGING DROP, temperature 293K |