4A0M
CRYSTAL STRUCTURE OF BETAINE ALDEHYDE DEHYDROGENASE FROM SPINACH IN COMPLEX WITH NAD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-11-18 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 69.406, 80.979, 85.540 |
| Unit cell angles | 79.06, 84.94, 77.99 |
Refinement procedure
| Resolution | 29.078 - 2.300 |
| R-factor | 0.2343 |
| Rwork | 0.213 |
| R-free | 0.24670 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3FG0 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.448 |
| Data reduction software | XDS |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.430 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.040 | 0.380 |
| Number of reflections | 76619 | |
| <I/σ(I)> | 14.5 | 2.56 |
| Completeness [%] | 93.2 | 81.1 |
| Redundancy | 2.28 | 2.22 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | CRYSTALS WERE GROWN IN 0.085 M TRIS HYDROCHLORIDE PH 8.5, 0.17 M SODIUM ACETATE TRIHYDRATE, 25.5% W/V POLYETHYLENE GLYCOL 4,000, 15% V/V GLYCEROL. |
