2OWV
Crystal structure of PH0725 from Pyrococcus horikoshii OT3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-09-06 |
Detector | RIGAKU RAXIS V |
Wavelength(s) | 1.54 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 106.188, 106.188, 137.673 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.970 - 2.800 |
R-factor | 0.213 |
Rwork | 0.213 |
R-free | 0.25200 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1wng |
RMSD bond length | 0.011 |
RMSD bond angle | 1.500 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.900 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.095 | 0.586 |
Number of reflections | 19853 | |
<I/σ(I)> | 8.6 | 3.6 |
Completeness [%] | 99.8 | 100 |
Redundancy | 9.2 | 9.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | oil microbatch | 5.5 | 295 | 3.86M Sodium formate, 0.1M Acetate, pH 5.5, oil microbatch, temperature 295K |