4O8V
O-Acetyltransferase Domain of Pseudomonas putida AlgJ
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-04-17 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 192.493, 33.998, 82.915 |
| Unit cell angles | 90.00, 91.93, 90.00 |
Refinement procedure
| Resolution | 48.096 - 1.815 |
| R-factor | 0.1778 |
| Rwork | 0.176 |
| R-free | 0.21550 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.096 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.900 |
| High resolution limit [Å] | 1.815 | 1.815 |
| Rmerge | 0.101 | 0.454 |
| Number of reflections | 48465 | |
| Completeness [%] | 98.8 | 96.2 |
| Redundancy | 7.5 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 293 | 0.2 M magnesium chloride, 0.1 M Bis-Tris pH 5.5, 25% (w/v) PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
