2YGI
Methanobactin HM1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-02-27 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 9.072, 22.535, 23.572 |
| Unit cell angles | 64.79, 86.06, 91.77 |
Refinement procedure
| Resolution | 30.000 - 0.800 |
| R-factor | 0.0652 |
| R-free | 0.08940 |
| Structure solution method | AB INITIO PHASING |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.012 |
| RMSD bond angle | 0.000 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | SHELX |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.440 | 0.840 |
| High resolution limit [Å] | 0.800 | 0.800 |
| Rmerge | 0.060 | 0.360 |
| Number of reflections | 12760 | |
| <I/σ(I)> | 15.3 | 3.3 |
| Completeness [%] | 75.7 | 20.2 |
| Redundancy | 3.8 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | 3.8 AMMONIUM SULFATE, 100 MM SODIUM CITRATE PH 5.6. |
