1EGV
CRYSTAL STRUCTURE OF THE DIOL DEHYDRATASE-ADENINYLPENTYLCOBALAMIN COMPLEX FROM KLEBSELLA OXYTOCA UNDER THE ILLUMINATED CONDITION.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL44B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 1999-11-12 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 73.380, 121.400, 207.600 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.750 |
| R-factor | 0.155 |
| Rwork | 0.152 |
| R-free | 0.21400 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.023 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | CNS |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.000 | 1.810 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.063 | 0.119 |
| Total number of observations | 2393925 * | |
| Number of reflections | 151116 | |
| <I/σ(I)> | 18.37 | |
| Completeness [%] | 80.0 | 54.1 |
| Redundancy | 4.65 | 3.13 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | vapor diffusion, sandwich drop * | 8 | 277 | Masuda, J., (1999) Acta Crystallogr, D55, 907. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | Tris-HCl | 20 (mM) | |
| 2 | 1 | 1 | ammonium sulfate | 0.24 (M) | |
| 3 | 1 | 1 | PEG6000 | 15 (%) | |
| 4 | 1 | 1 | LDAO | 0.20 (%) |
