4YWO
Mercuric reductase from Metallosphaera sedula
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-02-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 55.679, 95.895, 104.484 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 70.650 - 1.620 |
| R-factor | 0.16975 |
| Rwork | 0.168 |
| R-free | 0.19700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zk7 |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.340 |
| Data reduction software | HKL-2000 |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.650 | 1.640 |
| High resolution limit [Å] | 1.620 | 1.620 |
| Rmerge | 0.169 | 0.468 |
| Number of reflections | 71541 | |
| <I/σ(I)> | 13.2 | 2.1 |
| Completeness [%] | 99.1 | 85.7 |
| Redundancy | 5.9 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 300 | 0.085 M TRIS, 15% v/v glycerol, 14% w/v PEG400, 0.19 M LiSO4, and 20 mg/mL protein |
