Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 5ID-B |
| Synchrotron site | APS |
| Beamline | 5ID-B |
| Temperature [K] | 165 |
| Detector technology | CCD |
| Collection date | 2004-10-28 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.97857,0.97843,0.96321 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 109.907, 50.644, 63.676 |
| Unit cell angles | 90.00, 106.73, 90.00 |
Refinement procedure
| Resolution | 38.950 - 1.350 |
| R-factor | 0.16 |
| Rwork | 0.157 |
| R-free | 0.19400 |
| Structure solution method | MAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.563 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK (9.3D) |
| Phasing software | SOLVE (2.06) |
| Refinement software | REFMAC (refmac_5.4.0034) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 47.100 | 47.100 | 1.400 |
| High resolution limit [Å] | 1.350 | 2.910 | 1.350 |
| Rmerge | 0.044 | 0.025 | 0.428 |
| Total number of observations | 44744 | 44648 | |
| Number of reflections | 143557 | 13995 | 14350 |
| <I/σ(I)> | 12.2 | 38.7 | 2.8 |
| Completeness [%] | 99.4 | 96.9 | 99.3 |
| Redundancy | 3.14 | 3.1 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 295 | 1.0M Li sulfate monohydrate, 2% W/V PEG 8000 and 0.05% BME, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
