1BEX
STRUCTURE OF RUTHENIUM-MODIFIED PSEUDOMONAS AERUGINOSA AZURIN
Experimental procedure
| Temperature [K] | 100 |
| Detector technology | AREA DETECTOR |
| Collection date | 1993-07 |
| Detector | SIEMENS |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 100.600, 35.400, 74.700 |
| Unit cell angles | 90.00, 106.50, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.300 |
| R-factor | 0.209 |
| Rwork | 0.209 |
| R-free | 0.28900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ag0 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 28.100 * |
| Data reduction software | XENGEN |
| Data scaling software | XENGEN |
| Phasing software | X-PLOR (3.843) |
| Refinement software | X-PLOR (3.843) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.400 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.063 | 0.170 * |
| Total number of observations | 38571 * | |
| Number of reflections | 11083 | |
| <I/σ(I)> | 16.7 | 4.2 |
| Completeness [%] | 82.0 | |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 5 * | 30% PEG 4000, 100 MM LINO3,20 MM CUCL2,100 MM TRIS PH 8.0 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 30 (mg/ml) | |
| 2 | 1 | drop | 100 (mM) | ||
| 3 | 1 | reservoir | PEG4000 | 30 (%(w/v)) | |
| 4 | 1 | reservoir | 100 (mM) | ||
| 5 | 1 | reservoir | 20 (mM) | ||
| 6 | 1 | reservoir | Tris | 100 (mM) |
