3OWD
Crystal Structure of HSP90 with N-Aryl-benzimidazolone II
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2005-12-12 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 66.943, 85.574, 96.844 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.630 |
| R-factor | 0.1672 |
| Rwork | 0.165 |
| R-free | 0.19910 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.300 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | BUSTER-TNT (BUSTER-TNT 2.5.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.130 | 1.690 |
| High resolution limit [Å] | 1.630 | 1.630 |
| Number of reflections | 34661 | |
| Completeness [%] | 98.4 | 85.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 0.2M NaCl, 26 % PEG 3350, BTP, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
