2XJI
Structure and Copper-binding Properties of Methanobactins from Methylosinus trichosporium OB3b
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-08-01 |
| Detector | ADSC CCD |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 31.710, 39.570, 85.050 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.000 |
| R-factor | 0.1137 |
| R-free | 0.12910 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.026 |
| RMSD bond angle | 0.062 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELX |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 21.140 | 1.050 |
| High resolution limit [Å] | 1.000 | 1.000 |
| Rmerge | 0.090 | 0.360 |
| Number of reflections | 29329 | |
| <I/σ(I)> | 13.5 | 13.5 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 6.8 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 2M AMMONIUM SULFATE, 5% ISOPROPANOL, pH 7.5 |
