3Q9T
Crystal structure analysis of formate oxidase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-05 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.900 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 156.679, 156.019, 184.696 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.525 - 2.240 |
R-factor | 0.1865 |
Rwork | 0.184 |
R-free | 0.23600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1gal |
RMSD bond length | 0.007 |
RMSD bond angle | 1.192 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.240 | 2.240 |
Rmerge | 0.083 | 0.395 |
Number of reflections | 106962 | |
<I/σ(I)> | 13.3 | 4.03 |
Completeness [%] | 99.0 | 90.8 |
Redundancy | 6.8 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 6% PEG 4000, 0.1M sodium acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K |