2Z8Q
ferredoxin from Pyrococcus furiosus, D14C variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-3 |
| Synchrotron site | ESRF |
| Beamline | ID14-3 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-11-17 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.931 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 51.400, 116.800, 47.700 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.010 - 1.700 |
| R-factor | 0.1656 |
| Rwork | 0.164 |
| R-free | 0.19396 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1sj1 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.292 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.940 | 1.800 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.112 | 0.258 |
| Number of reflections | 16226 | |
| <I/σ(I)> | 11.41 | 5 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 7 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 35% PEG 600, 0.1 MIB pH 7.5, 7mM [Co(NH3)6]Cl3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
