9Y2E
Rubredoxin from Pyrococcus Furiosus at 100K, formyl-Methionine N-terminus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-06-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.88557 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 33.961, 34.403, 43.365 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.950 - 0.780 |
| R-factor | 0.13232 |
| Rwork | 0.132 |
| R-free | 0.13950 |
| Structure solution method | SAD |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.816 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | HKL2Map |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.400 | 0.800 |
| High resolution limit [Å] | 0.780 | 0.780 |
| Rmerge | 0.036 | 1.336 |
| Rpim | 0.033 | 1.336 |
| Number of reflections | 55180 | 1753 |
| <I/σ(I)> | 10.4 | 1.4 |
| Completeness [%] | 95.7 | 61 |
| Redundancy | 2.6 | 1.4 |
| CC(1/2) | 0.998 | 0.114 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | VAPOR DIFFUSION AGAINST 3.1 M NaCl with 3.6M Na,K PHOSPHATE, pH 8.0 |
