3CQR
Crystal Structure of the Lipocalin domain of Violaxanthin de-epoxidase (VDE) at pH5
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-09-10 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.97972 |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 122.297, 122.297, 158.337 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.200 - 2.000 |
| R-factor | 0.209 |
| Rwork | 0.208 |
| R-free | 0.23400 |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.797 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.070 | 0.267 |
| Number of reflections | 39345 | |
| <I/σ(I)> | 5.6 | 1.3 |
| Completeness [%] | 98.6 | 100 |
| Redundancy | 6.9 | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 5 | 298 | Sodium Acetate trihydrate pH5, Ammonium Sulfate 2.0M, VAPOR DIFFUSION, temperature 298K |
