Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X25 |
| Synchrotron site | NSLS |
| Beamline | X25 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-10-27 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.90590, 0.964, 0.9788, 0.9791 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.324, 80.292, 50.419 |
| Unit cell angles | 90.00, 99.16, 90.00 |
Refinement procedure
| Resolution | 33.890 - 1.700 |
| R-factor | 0.219 |
| Rwork | 0.190 |
| R-free | 0.21900 |
| Structure solution method | MAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.300 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.890 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Number of reflections | 58881 | |
| <I/σ(I)> | 7.2 | 3.9 |
| Completeness [%] | 92.4 | 94.1 |
| Redundancy | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | Na acetate, LiCl, ammonium sulphate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
