1BG8
HDEA FROM ESCHERICHIA COLI
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 293 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-02-16 |
| Detector | MAR scanner 345 mm plate |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 47.476, 76.149, 73.607 |
| Unit cell angles | 90.00, 98.93, 90.00 |
Refinement procedure
| Resolution | 10.000 - 2.200 |
| R-factor | 0.163 |
| Rwork | 0.163 |
| R-free | 0.27800 |
| Structure solution method | MULTIPLE ISOMORPHOUS REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 24.365 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | X-PLOR (3.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.260 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.071 * | |
| Number of reflections | 12863 | |
| <I/σ(I)> | 8.4 | |
| Completeness [%] | 97.2 | 94.8 |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 3.6 | 36% PEG400, 5% GLYCEROL, 50MM SODIUM CITRATE, PH 3.6 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG400 | 36 (%) | |
| 2 | 1 | reservoir | glycerol | 5 (%) | |
| 3 | 1 | reservoir | sodium citrate | 50 (mM) |
