1DIO
DIOL DEHYDRATASE-CYANOCOBALAMIN COMPLEX FROM KLEBSIELLA OXYTOCA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 277 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-03 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 76.200, 122.300, 209.600 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 10.000 - 2.200 |
| R-factor | 0.188 |
| Rwork | 0.187 |
| R-free | 0.23600 |
| Structure solution method | MIR |
| RMSD bond length | 0.014 |
| RMSD bond angle | 0.038 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.052 | 0.194 |
| Total number of observations | 384295 * | |
| Number of reflections | 86302 | |
| <I/σ(I)> | 10.51 | 2.32 |
| Completeness [%] | 83.5 | 64.5 |
| Redundancy | 2.95 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | sandwich-drop vapor diffusion * | 8 | 4 * | pH 8.0 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG6000 | 15 (%(w/v)) | |
| 2 | 1 | reservoir | ammonium sulfate | 0.24 (M) | |
| 3 | 1 | reservoir | Tris-HCl | 20 (mM) | |
| 4 | 1 | reservoir | LDAO | 0.20 (%) |
