2ORW
Thermotoga maritima thymidine kinase 1 like enzyme in complex with TP4A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-12-11 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.00 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 102.550, 59.630, 61.440 |
| Unit cell angles | 90.00, 103.11, 90.00 |
Refinement procedure
| Resolution | 28.000 - 1.500 |
| R-factor | 0.173 |
| Rwork | 0.169 |
| R-free | 0.20800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.778 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.000 | 1.540 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 55419 | |
| <I/σ(I)> | 10.44 | 2.9 |
| Completeness [%] | 95.8 | 88.7 |
| Redundancy | 3 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 65% 2-methyl-2,4-pentanediol (MPD), 0.1 M Na-Acetate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
