2YOX
Bacillus amyloliquefaciens CBM33 in complex with Cu(I) after photoreduction
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-08 |
| Detector | DECTRIS PILATUS 2M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.765, 73.549, 75.846 |
| Unit cell angles | 90.00, 100.33, 90.00 |
Refinement procedure
| Resolution | 19.930 - 1.900 |
| R-factor | 0.21782 |
| Rwork | 0.215 |
| R-free | 0.26964 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2ben |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.539 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.930 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.120 | 0.480 |
| Number of reflections | 29332 | |
| <I/σ(I)> | 9.3 | 2.7 |
| Completeness [%] | 98.8 | 99.1 |
| Redundancy | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4 | 0.1 M MMT BUFFER PH 4.0, 25% PEG-1500 |
