2I6Q
Complement component C2a
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-09-29 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9330 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 51.482, 77.185, 70.858 |
| Unit cell angles | 90.00, 109.55, 90.00 |
Refinement procedure
| Resolution | 50.500 - 2.100 |
| Rwork | 0.189 |
| R-free | 0.24000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | : 2I6S |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.861 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.500 | 2.210 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.061 | 0.523 |
| Total number of observations | 7222 | |
| Number of reflections | 27471 | |
| <I/σ(I)> | 10.4 | 1.5 |
| Completeness [%] | 89.9 | 57.4 |
| Redundancy | 3.6 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 35% PEG 1000, 0.025 M sodium malonate, 0.0375 M imidazole, 0.0375 M boric acid, 3% xylitol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
