3TAH
Crystal structure of an S. thermophilus NFeoB N11A mutant bound to mGDP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-02-05 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 60.100, 63.800, 265.200 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.850 |
| R-factor | 0.17776 |
| Rwork | 0.176 |
| R-free | 0.21612 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3lx8 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.502 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.880 |
| High resolution limit [Å] | 1.850 | 5.020 | 1.850 |
| Rmerge | 0.039 | 0.379 | |
| Number of reflections | 43892 | ||
| <I/σ(I)> | 24.9 | 2.5 | |
| Completeness [%] | 99.3 | 98.6 | 93.4 |
| Redundancy | 6.2 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 0.2M LiCl, 0.1M Mes, 20% PEG 6000, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
