3GR9
Crystal structure of ColD H188K S187N
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2009-02-05 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 69.728, 114.659, 114.568 |
| Unit cell angles | 78.98, 76.23, 76.33 |
Refinement procedure
| Resolution | 50.000 - 2.200 |
| R-factor | 0.18 |
| Rwork | 0.177 |
| R-free | 0.27200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2r0t |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.800 |
| Data reduction software | SAINT |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | TNT |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.300 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 160879 | |
| <I/σ(I)> | 1.1 | |
| Completeness [%] | 95.6 | 92.2 |
| Redundancy | 3.42 | 1.97 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | batch | 6 | 298 | Precipitant:20-25% PEG 3400, 100 mM MES, 200 mM MgCl2, pH 6.0, batch, temperature 298K |
