2XL8
REDUCED STRUCTURE OF R124F MUTANT OF CYTOCHROME C' FROM ALCALIGENES XYLOSOXIDANS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX10.1 |
| Synchrotron site | SRS |
| Beamline | PX10.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-03-02 |
| Detector | MARRESEARCH |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 53.681, 53.681, 181.205 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 46.470 - 1.140 |
| R-factor | 0.14118 |
| Rwork | 0.140 |
| R-free | 0.16147 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1e84 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.828 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.000 | 1.180 |
| High resolution limit [Å] | 1.140 | 1.140 |
| Rmerge | 0.056 | 0.219 |
| Number of reflections | 56022 | |
| <I/σ(I)> | 31 | 5 |
| Completeness [%] | 97.4 | 83.9 |
| Redundancy | 8.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 294 | SULPHATE AMMONIUM, TRIS PH 7.5 |
