2H9D
Pyruvate-Bound Structure of the Isochorismate-Pyruvate Lyase from Pseudomonas aerugionsa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 138 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-09-22 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 54.523, 74.636, 88.902 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 57.200 - 1.950 |
| R-factor | 0.21 |
| Rwork | 0.210 |
| R-free | 0.25200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2h9c |
| RMSD bond length | 0.001 |
| RMSD bond angle | 1.080 |
| Data reduction software | CrystalClear ((MSC/RIGAKU)) |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.200 | 2.020 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.066 | 0.405 |
| Number of reflections | 25853 | |
| Completeness [%] | 95.0 | 75.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 100 mM ADA, 25% PEG 3350, 0.15 M calcium acetate, 10% glycerol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
