3V3X
Nitroxide Spin Labels in Protein GB1: N8/K28 Double Mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-07-19 |
| Detector | RIGAKU SATURN 944 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 105.248, 35.747, 86.989 |
| Unit cell angles | 90.00, 126.37, 90.00 |
Refinement procedure
| Resolution | 25.000 - 2.000 |
| R-factor | 0.2313 |
| Rwork | 0.228 |
| R-free | 0.28793 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB 2QMT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 2.165 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 27.300 |
| High resolution limit [Å] | 2.000 |
| Rmerge | 0.049 |
| Number of reflections | 17743 |
| <I/σ(I)> | 15.5 |
| Completeness [%] | 98.8 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 298 | 150 mM sodium acetate pH 4.5, 18% w/v PEG 3350 , VAPOR DIFFUSION, HANGING DROP, temperature 298K |
