Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-02-17 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 61.000, 65.810, 99.580 |
| Unit cell angles | 89.99, 90.00, 89.99 |
Refinement procedure
| Resolution | 40.810 - 1.690 |
| R-factor | 0.17188 |
| Rwork | 0.170 |
| R-free | 0.20762 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.937 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | autoSHARP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.740 | 1.720 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Rmerge | 0.100 | 0.710 |
| Number of reflections | 153732 | |
| <I/σ(I)> | 5 | 1.1 |
| Completeness [%] | 89.0 | 85.6 |
| Redundancy | 1.9 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1 M TRIS (PH 8.0), 2 MM ZNCL2, 20% PEG 6000 |
