3G64
Crystal structure of putative enoyl-CoA hydratase from Streptomyces coelicolor A3(2)
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-12-14 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97923 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 116.167, 191.297, 93.723 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.600 - 2.050 |
| R-factor | 0.156 |
| Rwork | 0.154 |
| R-free | 0.19400 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.312 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.600 | 2.090 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.135 | 0.807 |
| Number of reflections | 123443 | |
| <I/σ(I)> | 8.3 | 2.2 |
| Completeness [%] | 98.7 | 92.6 |
| Redundancy | 9.1 | 8.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 0.1M Bis-Tris pH 6.5, 2.5M Ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
