3ZC1
Crystal structure of AfC3PO
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 | 2010-10-01 |
| Detector | ADSC CCD |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 183.310, 183.310, 111.280 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.560 - 3.269 |
| R-factor | 0.2246 |
| Rwork | 0.221 |
| R-free | 0.28130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zc0 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.279 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | SnB |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 70.750 | 3.350 |
| High resolution limit [Å] | 3.270 | 3.270 |
| Rmerge | 0.080 | 0.750 |
| Number of reflections | 29895 | |
| <I/σ(I)> | 17.5 | 2.8 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 9.2 | 9.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 9.5 - 10 % PEG 3K, 100 MM KCL, 200 MM MGCL2, 40 MM SODIUM CACODYLATE PH 5.5, 5 MM DTT. |
