3BXV
Crystal structure studies on sulfur oxygenase reductase from Acidianus tengchongensis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6B |
Synchrotron site | Photon Factory |
Beamline | BL-6B |
Temperature [K] | 77 |
Detector technology | IMAGE PLATE |
Collection date | 2003-12-01 |
Detector | RIGAKU |
Wavelength(s) | 1 |
Spacegroup name | I 4 3 2 |
Unit cell lengths | 159.130, 159.130, 159.130 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.050 - 2.700 |
R-factor | 0.194 |
Rwork | 0.192 |
R-free | 0.21300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2cb2 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.730 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.082 | 0.377 |
Number of reflections | 9761 | |
<I/σ(I)> | 22.7 | 3.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 9.6 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 303 | 1.08M NaCitr3, 0.1M Na-Hepes, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 303K |