5JO9
Structural characterization of the thermostable Bradyrhizobium japonicum d-sorbitol dehydrogenase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2011-04-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.8999 |
Spacegroup name | P 62 2 2 |
Unit cell lengths | 100.879, 100.879, 88.600 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 43.834 - 2.894 |
R-factor | 0.2713 |
Rwork | 0.270 |
R-free | 0.29510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4nbu |
RMSD bond length | 0.004 |
RMSD bond angle | 0.765 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.870 | 3.070 |
High resolution limit [Å] | 2.894 | 2.894 |
Rmeas | 0.247 | 2.485 |
Number of reflections | 6287 | |
<I/σ(I)> | 12.4 | 1.14 |
Completeness [%] | 99.5 | 98 |
Redundancy | 10.32 | 10.17 |
CC(1/2) | 0.996 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 5.6 | 294 | 1.4 M NaH2PO4/K2HPO4 pH 5.6 |