4P93
Structure of Dienelactone Hydrolase at 1.85 A resolution crystallised in the C2 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | OTHER |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-10-15 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 100.230, 49.050, 89.610 |
| Unit cell angles | 90.00, 94.30, 90.00 |
Refinement procedure
| Resolution | 89.360 - 1.850 |
| R-factor | 0.1746 |
| Rwork | 0.173 |
| R-free | 0.20536 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zi6 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.087 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 89.360 | 1.900 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 35229 | |
| <I/σ(I)> | 16.89 | 5.1 |
| Completeness [%] | 94.0 | 88.9 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 291 | Sodium Citrate |
