5VYY
Structure of human Hsp90-alpha bound to resorcinylic inhibitor BnIm
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-31 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97946 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 67.075, 92.055, 85.262 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.510 - 1.792 |
| R-factor | 0.1868 |
| Rwork | 0.184 |
| R-free | 0.21850 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.085 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX (1.11) |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.510 | 1.830 |
| High resolution limit [Å] | 1.790 | 1.792 |
| Rmerge | 0.066 | 0.430 |
| Number of reflections | 24883 | 1217 |
| <I/σ(I)> | 30.8 | 3.2 |
| Completeness [%] | 99.4 | 98.9 |
| Redundancy | 3.6 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | PEG 2000 MME, Sodium formate, Sodium cacodylate |
