3EPN
Crystal structure of Caulobacter crescentus ThiC complexed with imidazole ribonucleotide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-03-28 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.603, 102.738, 82.635 |
| Unit cell angles | 90.00, 102.05, 90.00 |
Refinement procedure
| Resolution | 35.240 - 2.110 |
| R-factor | 0.172 |
| Rwork | 0.168 |
| R-free | 0.24900 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.996 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.190 |
| High resolution limit [Å] | 2.110 | 4.540 | 2.110 |
| Rmerge | 0.164 | 0.085 | 0.317 |
| Number of reflections | 52600 | ||
| Completeness [%] | 90.1 | 94 | 75.1 |
| Redundancy | 2.7 | 3.4 | 1.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 1.4 M sodium citrate, 0.1 M sodium HEPES, pH 7.5, vapor diffusion, hanging drop, temperature 298K |
