5LR1
CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH A003498614A.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-10-24 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9393 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 66.540, 90.680, 98.230 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.760 - 1.440 |
| R-factor | 0.2 |
| Rwork | 0.199 |
| R-free | 0.22000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yjx |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.040 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.340 | 1.460 |
| High resolution limit [Å] | 1.440 | 1.440 |
| Rmerge | 0.349 | |
| Number of reflections | 53831 | |
| <I/σ(I)> | 20 | 3.6 |
| Completeness [%] | 99.3 | 90.3 |
| Redundancy | 3.6 | 3.4 |
| CC(1/2) | 0.854 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 1.0 to 1.4 M Sodium Citrate |
