1Y07
Crystal structure of the superoxide reductase from Treponema pallidum
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-07-08 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.739, 1.033 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 119.311, 59.946, 65.520 |
| Unit cell angles | 90.00, 104.96, 90.00 |
Refinement procedure
| Resolution | 63.250 - 1.550 |
| R-factor | 0.1845 |
| Rwork | 0.182 |
| R-free | 0.23522 |
| Structure solution method | MAD |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.765 |
| Data reduction software | HKL-2000 |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 63.250 | 1.630 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.046 | 0.196 |
| Number of reflections | 53059 | |
| <I/σ(I)> | 8.8 | 4.3 |
| Completeness [%] | 82.4 | 82.4 |
| Redundancy | 6.9 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | PEG 3350, magnesium chloride, trisHCl, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K |
