Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-03-14 |
| Detector | MARRESEARCH |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 224.664, 224.664, 336.361 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 169.031 - 2.800 |
| R-factor | 0.173 |
| Rwork | 0.169 |
| R-free | 0.24730 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2x0x |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.596 |
| Data reduction software | MOSFLM |
| Data scaling software | TRUNCATE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 84.210 | 2.820 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.150 | 0.580 |
| Number of reflections | 75099 | |
| <I/σ(I)> | 12.93 | 2.3 |
| Completeness [%] | 93.7 | 96.8 |
| Redundancy | 5.97 | 5.54 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | LITHIUM SULPHATE 1.5M, SODIUM CHLORIDE BUFFER PH 6. |
