3AQS
Crystal structure of RolR (NCGL1110) without ligand
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2007-06-18 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 41 2 2 |
| Unit cell lengths | 152.950, 152.950, 117.480 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 93.170 - 3.600 |
| R-factor | 0.22 |
| Rwork | 0.220 |
| R-free | 0.29200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.300 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASES |
| Refinement software | CNS (1.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 108.460 | 3.790 |
| High resolution limit [Å] | 3.600 | 3.600 |
| Rmerge | 0.166 | 0.451 |
| Number of reflections | 16353 | |
| <I/σ(I)> | 13 | 2.9 |
| Completeness [%] | 98.1 | 93.8 |
| Redundancy | 5.7 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 300 | 3M ammonium sulfate, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 300K |
