1SBR
The structure and function of B. subtilis YkoF gene product: the complex with thiamin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ENRAF-NONIUS |
Temperature [K] | 120 |
Detector technology | IMAGE PLATE |
Collection date | 2003-09-16 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 58.820, 82.490, 86.110 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.300 |
R-factor | 0.20915 |
Rwork | 0.206 |
R-free | 0.26881 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1s99 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.669 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.075 | 0.306 |
Number of reflections | 16658 | |
<I/σ(I)> | 18.4 | 2.8 |
Completeness [%] | 49.7 | |
Redundancy | 4.7 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 295 | 20% PEG 8000, 0.2 M calcium acetate, 0.1 M MES , pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 295.0K, pH 6.50 |