1T3H
X-ray Structure of Dephospho-CoA Kinase from E. coli Norteast Structural Genomics Consortium Target ER57
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4A |
| Synchrotron site | NSLS |
| Beamline | X4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-02-02 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97932 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.630, 80.905, 75.454 |
| Unit cell angles | 90.00, 93.95, 90.00 |
Refinement procedure
| Resolution | 19.530 - 2.500 |
| R-factor | 0.238 |
| Rwork | 0.238 |
| R-free | 0.28400 |
| Structure solution method | SAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.700 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 20.000 |
| High resolution limit [Å] | 2.500 |
| Rmerge | 0.081 |
| Number of reflections | 45074 |
| <I/σ(I)> | 14.2 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 277 | 100 mM sodium acetate, 160 mM ammonium sulfate, 22% PEG 3350, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
