2VCI
4,5 Diaryl Isoxazole Hsp90 Chaperone Inhibitors: Potential Therapeutic Agents for the Treatment of Cancer
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-10-03 |
| Detector | RIGAKU IMAGE PLATE |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 65.144, 88.454, 99.025 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.490 - 2.000 |
| R-factor | 0.211 |
| Rwork | 0.207 |
| R-free | 0.27800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1uy6 |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.974 |
| Data reduction software | d*TREK |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.700 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.060 | 0.380 |
| Number of reflections | 45746 | |
| <I/σ(I)> | 9.3 | 2.2 |
| Completeness [%] | 96.6 | 86.1 |
| Redundancy | 2.38 | 1.75 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
