2P9X
Crystal structure of PH0832 from Pyrococcus horikoshii OT3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-06-05 |
Detector | RIGAKU RAXIS V |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.357, 65.870, 104.050 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.970 - 1.650 |
R-factor | 0.219 |
Rwork | 0.219 |
R-free | 0.24500 |
Structure solution method | MAD |
RMSD bond length | 1.100 |
RMSD bond angle | 0.005 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.059 | 0.627 |
Number of reflections | 52277 | |
<I/σ(I)> | 10.9 | 3.2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | oil-micro batch | 5.8 | 295 | 10% isopropanol, 0.1M cacodylate, 0.2M zinc acetate, pH 5.8, oil-micro batch, temperature 295K |