4O5U
Crystal structure of Alkylhydroperoxide Reductase subunit F from E. coli at 2.65 Ang resolution
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-06-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.0, 1.55072, 1.58994, 1.59048 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 106.698, 59.598, 123.715 |
| Unit cell angles | 90.00, 113.68, 90.00 |
Refinement procedure
| Resolution | 28.820 - 2.650 |
| R-factor | 0.174 |
| Rwork | 0.172 |
| R-free | 0.22000 |
| Structure solution method | MAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.908 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLOMON |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.740 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.098 | 0.341 |
| Number of reflections | 21022 | |
| <I/σ(I)> | 12.9 | 3.2 |
| Completeness [%] | 99.0 | 92.8 |
| Redundancy | 4 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 296 | 0.1 M Tris-HCl pH 8.5, 2 M ammonium sulfate, 10 mM cadmium chloride, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
