Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 298 |
| Detector technology | AREA DETECTOR |
| Collection date | 1994-11-01 |
| Detector | SIEMENS-NICOLET X100 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 150.700, 150.700, 150.700 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| R-factor | 0.158 |
| Rwork | 0.158 |
| R-free | 0.20700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1RUX |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.309 * |
| Data scaling software | XDS |
| Phasing software | CNS (0.9) |
| Refinement software | CNS (0.9) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.700 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.081 | 0.234 |
| Number of reflections | 36549 | |
| <I/σ(I)> | 14.6 | 3 |
| Completeness [%] | 92.0 * | 87.6 |
| Redundancy | 3.3 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 3.2 | 298 | Rux, J.J., (2000) MOL.THER., 1, 18. * |
