2IZ0
PEX inhibitor-home data
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-04-22 |
| Detector | RIGAKU IMAGE PLATE |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 70.957, 104.459, 241.478 |
| Unit cell angles | 90.00, 98.52, 90.00 |
Refinement procedure
| Resolution | 235.700 - 2.600 |
| R-factor | 0.126 |
| Rwork | 0.123 |
| R-free | 0.19300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.124 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 2.700 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.070 | 0.130 |
| Number of reflections | 52468 | |
| <I/σ(I)> | 41.7 | 11.2 |
| Completeness [%] | 97.5 | 83.4 |
| Redundancy | 2.9 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.2 | 25% PEG 3350, 0.1M SODIUM CACODYLATE PH 6.4, 300MM AMMONIUM ACETATE |
