8Q6U
Crystal structure of a double mutant acetyltransferase from Bacillus cereus species.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-07 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.573, 83.154, 53.194 |
| Unit cell angles | 90.00, 100.39, 90.00 |
Refinement procedure
| Resolution | 19.320 - 1.516 |
| R-factor | 0.1888 |
| Rwork | 0.187 |
| R-free | 0.21610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.040 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.321 | 1.636 |
| High resolution limit [Å] | 1.516 | 1.516 |
| Number of reflections | 31633 | 1583 |
| <I/σ(I)> | 10.6 | |
| Completeness [%] | 74.5 | |
| Redundancy | 6.3 | |
| CC(1/2) | 0.999 | 0.693 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 273 | 2mM zinc chloride, 100 mM Tris pH 8.0, 20 % w/v PEG 6000 |
