2WYV
High resolution structure of Thermus thermophilus enoyl-acyl carrier protein reductase NAD-form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-19 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.270, 107.800, 85.980 |
| Unit cell angles | 90.00, 95.89, 90.00 |
Refinement procedure
| Resolution | 39.750 - 1.860 |
| R-factor | 0.18277 |
| Rwork | 0.182 |
| R-free | 0.23926 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wyu |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.480 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.060 | 0.410 |
| Number of reflections | 77770 | |
| <I/σ(I)> | 10.1 | 2.2 |
| Completeness [%] | 95.9 | 89.2 |
| Redundancy | 2.9 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.4 | 20% (W/V) POLYETHYLENE GLYCOL 4000, 100 MM SODIUM CITRATE PH 5.4, 2 MM NAD |
