Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.2 |
| Synchrotron site | SRS |
| Beamline | PX14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-02-07 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.585, 65.803, 101.677 |
| Unit cell angles | 90.00, 89.96, 90.00 |
Refinement procedure
| Resolution | 30.124 - 1.945 |
| R-factor | 0.218 |
| Rwork | 0.218 |
| R-free | 0.25500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qcq |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.500 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.230 | 2.040 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.090 | 0.510 |
| Number of reflections | 602165 | |
| <I/σ(I)> | 14.43 | 2.53 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 4.36 | 4.27 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4.6 | 150 MM AMMONIUM SULPHATE, 100 MM SODIUM ACETATE TRIHYDRATE [PH 4.6], 25% W/V PEG MME 2000 |
