4AAN
MacA wild-type fully reduced
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-12-10 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 95.600, 46.970, 77.930 |
| Unit cell angles | 90.00, 90.94, 90.00 |
Refinement procedure
| Resolution | 77.920 - 1.220 |
| R-factor | 0.14788 |
| Rwork | 0.147 |
| R-free | 0.16624 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3hq6 |
| RMSD bond length | 0.026 |
| RMSD bond angle | 2.298 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0113) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.500 | 1.300 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Rmerge | 0.090 | 0.630 |
| Number of reflections | 103844 | |
| <I/σ(I)> | 9.4 | 2 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 3.9 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | 0.1 M SODIUM CITRATE PH 5.6, 1 M AMMONIUM PHOSPHATE |
