3HDT
Crystal structure of putative kinase from Clostridium symbiosum ATCC 14940
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-12-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97926 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 95.443, 95.443, 109.375 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.790 |
| R-factor | 0.21557 |
| Rwork | 0.212 |
| R-free | 0.27565 |
| Structure solution method | SAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.528 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.5.0054) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.820 |
| High resolution limit [Å] | 2.790 | 2.800 |
| Rmerge | 0.099 | 0.619 |
| Number of reflections | 13096 | |
| <I/σ(I)> | 44 | 5 |
| Completeness [%] | 99.9 | 99.7 |
| Redundancy | 13.9 | 13.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 289 | 0.1 M Acetic Acid pH 4.5, 20% 1,4-butanediol, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
