2ZI3
C4S-E247A dCK variant of dCK in complex with D-dA+ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-08-02 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 52.440, 133.290, 156.730 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.300 |
| R-factor | 0.22088 |
| Rwork | 0.211 |
| R-free | 0.30586 |
| Structure solution method | Rigid body refinement |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.628 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.440 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.132 | 0.545 |
| Number of reflections | 23174 | |
| <I/σ(I)> | 8.39 | 2.6 |
| Completeness [%] | 93.0 | 81.8 |
| Redundancy | 4.8 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 298 | 1.0M Sodium Citrate, 100mM Hepes, pH7.5, VAPOR DIFFUSION, temperature 298K |
