2JA1
Thymidine kinase from B. cereus with TTP bound as phosphate donor.
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 | 95.390, 95.390, 204.862 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.630 - 2.800 |
| R-factor | 0.198 |
| Rwork | 0.196 |
| R-free | 0.23900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2j9r |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.479 |
| 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] | 37.600 | 2.950 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmeas | 0.100 | 0.534 |
| Number of reflections | 12035 | |
| <I/σ(I)> | 26.8 | 4.2 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 13.6 | 14 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 60% MPD 0.1M HEPES PH7, pH 7.00 |
