1POI
CRYSTAL STRUCTURE OF GLUTACONATE COENZYME A-TRANSFERASE FROM ACIDAMINOCOCCUS FERMENTANS TO 2.55 ANGSTOMS RESOLUTION
Experimental procedure
| Temperature [K] | 298 |
| Detector technology | IMAGE PLATE |
| Collection date | 1995-05 |
| Detector | MARRESEARCH |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 145.120, 152.270, 130.610 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 7.000 - 2.500 |
| R-factor | 0.19 |
| Rwork | 0.190 |
| R-free | 0.27000 * |
| Structure solution method | MULTIPLE ISOMORPHOUS REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.800 |
| Data reduction software | MOSFLM (V. 5.23) |
| Data scaling software | CCP4 ((AGROVATA) |
| Phasing software | X-PLOR (3.1) |
| Refinement software | X-PLOR (3.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 7.000 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.550 |
| Rmerge | 0.098 | |
| Number of reflections | 37201 | |
| Completeness [%] | 83.0 | 32 |
| Redundancy | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, sitting drop * | 5.5 | 20 * | AMMONIUM SULFATE/PEG PH=5.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 16 (mg/ml) | |
| 2 | 1 | drop | ammonium sulfate | 0.93 (M) | |
| 3 | 1 | drop | MES | 24 (mM) | |
| 4 | 1 | drop | 0.2 (mM) | ||
| 5 | 1 | drop | PEG8000 | 1 (%) | |
| 6 | 1 | reservoir | ammonium sulfate | 1.65 (M) | |
| 7 | 1 | reservoir | MES | 0.1 (M) | |
| 8 | 1 | reservoir | 1 (mM) | ||
| 9 | 1 | reservoir | PEG8000 | 5 (%) |
