3FTO
Crystal structure of OppA in a open conformation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM16 |
| Synchrotron site | ESRF |
| Beamline | BM16 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-04-20 |
| Detector | ADSC Q210r |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.577, 122.287, 59.408 |
| Unit cell angles | 90.00, 102.05, 90.00 |
Refinement procedure
| Resolution | 21.230 - 2.380 |
| R-factor | 0.214 |
| Rwork | 0.211 |
| R-free | 0.27600 |
| Structure solution method | SAD |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.642 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MLPHARE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.470 |
| High resolution limit [Å] | 2.380 | 5.130 | 2.380 |
| Rmerge | 0.083 | 0.085 | 0.158 |
| Number of reflections | 22117 | ||
| <I/σ(I)> | 44.886 | ||
| Completeness [%] | 99.8 | 98.5 | 100 |
| Redundancy | 6.2 | 6.1 | 6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.2M NaCl, 0.1M Na-Hepes, 20% PEG 6000, pH 7.0, vapor diffusion, hanging drop, temperature 293K |
