3VRD
Crystal structure of flavocytochrome c from Thermochromatium tepidum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-12-01 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | I 4 |
| Unit cell lengths | 140.617, 140.617, 57.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.500 |
| R-factor | 0.16148 |
| Rwork | 0.160 |
| R-free | 0.19511 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1fcd |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.744 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.091 | 0.278 |
| Number of reflections | 84166 | |
| <I/σ(I)> | 22.6 | 3 |
| Completeness [%] | 93.4 | 84.5 |
| Redundancy | 4.6 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 18% PEG 3000, 0.2M potassium nitrate, 0.05M MES-NaOH, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
