4I19
The crystal structure of an epoxide hydrolase from Streptomyces carzinostaticus subsp. neocarzinostaticus.
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 | 2012-04-16 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97915 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 76.011, 76.011, 161.263 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.262 - 2.148 |
| R-factor | 0.1648 |
| Rwork | 0.162 |
| R-free | 0.20870 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.040 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXD |
| Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.500 | 2.190 |
| High resolution limit [Å] | 2.148 | 2.150 |
| Rmerge | 0.122 | 0.604 |
| Number of reflections | 26537 | |
| <I/σ(I)> | 31.3 | 4.6 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 9.2 | 9.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 1.4M Sodium Malonate, 0.1M Bis-Tris Propane:NaOH, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
