5BMH
Nitroxide Spin Labels in Protein GB1: T44 Mutant, Crystal Form B
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-05-02 |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 25.037, 37.194, 49.217 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.608 - 1.600 |
| R-factor | 0.1562 |
| Rwork | 0.155 |
| R-free | 0.17460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2qmt |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.424 |
| Data reduction software | CrystalClear |
| Data scaling software | CrystalClear |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.050 | 1.660 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.052 | 0.316 |
| Number of reflections | 6458 | |
| <I/σ(I)> | 24 | 3.1 |
| Completeness [%] | 100.0 | 97.2 |
| Redundancy | 6 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | 0.2 M potassium sodium tartrate, 0.2 M sodium citrate pH 6.0, 2 M ammonium sulfate |
