2POM
TAB1 with manganese ion
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 213 |
| Detector technology | CCD |
| Collection date | 2006-03-06 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97919 |
| Spacegroup name | P 3 2 1 |
| Unit cell lengths | 141.618, 141.618, 66.153 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 50.000 - 2.270 |
| Rwork | 0.211 |
| R-free | 0.23300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | The TAB1 model solved by ourselves but Not deposited yet |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.260 |
| High resolution limit [Å] | 2.220 | 6.020 | 2.220 |
| Rmerge | 0.069 | 0.037 | 0.459 |
| Number of reflections | 35865 | ||
| <I/σ(I)> | 13.2 | ||
| Completeness [%] | 95.0 | 93.9 | 71 |
| Redundancy | 6.2 | 6.5 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 295 | 1.5M Li2SO4, 0.1M Hepes, 1mM MnCl2, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
