5HZ4
The structural and biochemical characterization of acyl-coa hydrolase mutant Thr60Ala from Staphylococcus aureus.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-03-31 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.050, 128.540, 84.360 |
| Unit cell angles | 90.00, 104.20, 90.00 |
Refinement procedure
| Resolution | 31.700 - 2.500 |
| R-factor | 0.23786 |
| Rwork | 0.236 |
| R-free | 0.28297 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ncp |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.700 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.122 | 0.670 |
| Number of reflections | 35749 | |
| <I/σ(I)> | 9.6 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 5.5 | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | 296 | 30% PEG4000, 0.1M tris pH 8.5, 0.2 M lithium sulfate |
