5K7F
Crystal structure of apo AibR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-08-27 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.0003 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.664, 95.225, 62.051 |
| Unit cell angles | 90.00, 105.55, 90.00 |
Refinement procedure
| Resolution | 38.210 - 1.700 |
| R-factor | 0.208 |
| Rwork | 0.206 |
| R-free | 0.24230 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.022 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.3.11) |
| Phasing software | SHELXCD |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 38.210 | 38.210 | 1.730 |
| High resolution limit [Å] | 1.700 | 9.000 | 1.700 |
| Rmerge | 0.140 | 0.052 | 0.712 |
| Number of reflections | 48521 | ||
| <I/σ(I)> | 11.3 | ||
| Completeness [%] | 99.4 | 99.2 | 99.6 |
| Redundancy | 6.3 | 6.6 | 6.3 |
| CC(1/2) | 0.990 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Tris-HCL pH 7.4, 0.2 M ammonium acetate, 20 % PEG 3350 |
