5W1E
PobR in complex with PHB
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-02-04 |
| Detector | RIGAKU SATURN 944+ |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.134, 87.924, 69.915 |
| Unit cell angles | 90.00, 96.22, 90.00 |
Refinement procedure
| Resolution | 32.319 - 2.060 |
| R-factor | 0.1664 |
| Rwork | 0.164 |
| R-free | 0.20620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ia2 |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.548 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX ((1.11.1_2575)) |
| Refinement software | PHENIX ((1.11.1_2575)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.100 |
| High resolution limit [Å] | 2.060 | 2.060 |
| Rmerge | 0.088 | 0.330 |
| Number of reflections | 32727 | 1568 |
| <I/σ(I)> | 26.6 | |
| Completeness [%] | 99.7 | 95.6 |
| Redundancy | 7.3 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 12% PEG MME 2000, 0.1 M MES, pH 5.8, 17.5 mM ammonium sulfate |
