4ZRC
Crystal structure of MSM-13, a putative T1-like thiolase from Mycobacterium smegmatis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-06-01 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54179 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 75.460, 104.140, 104.570 |
| Unit cell angles | 90.00, 107.53, 90.00 |
Refinement procedure
| Resolution | 47.520 - 2.700 |
| R-factor | 0.2259 |
| Rwork | 0.223 |
| R-free | 0.28329 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.604 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 47.520 |
| High resolution limit [Å] | 2.430 |
| Number of reflections | 201832 |
| <I/σ(I)> | 8.2 |
| Completeness [%] | 98.9 |
| Redundancy | 1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 295 | 0.2M sodium acetate trihydrate, 0.1M sodium cacodylatetrihydrate pH 6.5, 30% PEG 8000, 5% n-octyl-D-glucoside |
