4KSM
Crystal structure of Escherichia coli glutraredoxin 2 C9S/C12S mutant without glutathione
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-D |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 28.160, 78.650, 89.160 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.490 - 2.400 |
| R-factor | 0.2105 |
| Rwork | 0.206 |
| R-free | 0.28830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.176 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Phasing software | AMoRE |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.490 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.150 | 0.400 |
| Number of reflections | 8139 | |
| <I/σ(I)> | 5 | 1.8 |
| Completeness [%] | 98.7 | 99.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.9 | 277 | 0.1 M sodium citrate, 0.2 M ammonium acetate and 30% PEG 4000, pH 5.9, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
