5WEH
Cytochrome c oxidase from Rhodobacter sphaeroides in the reduced state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-07-20 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1 |
| Spacegroup name | H 3 |
| Unit cell lengths | 339.221, 339.221, 89.199 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 28.450 - 3.450 |
| R-factor | 0.2244 |
| Rwork | 0.223 |
| R-free | 0.26150 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1m56 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.683 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 3.570 |
| High resolution limit [Å] | 3.450 | 3.450 |
| Rmerge | 0.085 | 0.370 |
| Number of reflections | 48530 | 3998 |
| <I/σ(I)> | 11.8 | |
| Completeness [%] | 94.6 | 77.8 |
| Redundancy | 5.1 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.9 | 278 | PEG400 23%, MES pH 5.9, Sodium Chloride 50 mM, |
