Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 8-BM |
| Synchrotron site | APS |
| Beamline | 8-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-07-14 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 76.915, 80.717, 141.042 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.225 - 2.797 |
| R-factor | 0.2107 |
| Rwork | 0.208 |
| R-free | 0.26980 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.847 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SnB |
| Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 6.030 | 2.800 |
| Rmerge | 0.105 | 0.054 | 0.405 |
| Number of reflections | 11147 | ||
| <I/σ(I)> | 16.1 | ||
| Completeness [%] | 99.7 | 97.8 | 100 |
| Redundancy | 8.9 | 8.1 | 9.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 4.4 M NaCl, 50 mM Tris, 5% ethylene glycol, pH 7.5, vapor diffusion, hanging drop, temperature 291K |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 4.4 M NaCl, 50 mM Tris, 5% ethylene glycol, pH 7.5, vapor diffusion, hanging drop, temperature 291K |
