2J9R
Thymidine kinase from B. anthracis in complex with dT.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 73.171, 73.171, 223.734 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.870 - 2.700 |
| R-factor | 0.205 |
| Rwork | 0.203 |
| R-free | 0.24400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDP ENTRY 1XMR |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.343 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.870 | 2.850 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.110 | 0.490 |
| Number of reflections | 8799 | |
| <I/σ(I)> | 22.6 | 5.9 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 14.1 | 14.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | 5% 1,2-PROPANEDIOL 0.1M NA/K PHOSPHATE PH 6 10% GLYCEROL |
