5F38
X-ray crystal structure of a thiolase from Escherichia coli at 1.8 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2014-11-13 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.794, 76.254, 266.607 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 36.800 - 1.900 |
| R-factor | 0.19865 |
| Rwork | 0.197 |
| R-free | 0.23481 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5f0v |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.733 |
| Data reduction software | SCALA |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.800 | |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.012 | 0.117 |
| Number of reflections | 150897 | |
| <I/σ(I)> | 2.1 | 2.1 |
| Completeness [%] | 99.5 | 99.5 |
| Redundancy | 12.6 | 12.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 295 | 0.1 M Bis-tris propane pH 8.0, 35% PEG6000, 0.05 LiCl2 |
