5LRL
CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH A003492875
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-06-23 |
| Detector | ADSC QUANTUM 4r |
| Wavelength(s) | 0.934 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 66.460, 90.700, 98.530 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 18.730 - 1.330 |
| R-factor | 0.175 |
| Rwork | 0.174 |
| R-free | 0.18900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2yjx |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.050 |
| 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] | 66.730 | 1.400 |
| High resolution limit [Å] | 1.330 | 1.330 |
| Rmerge | 0.387 | |
| Number of reflections | 63093 | |
| <I/σ(I)> | 20.7 | 2.2 |
| Completeness [%] | 91.8 | 90.1 |
| Redundancy | 4.6 | 2.5 |
| CC(1/2) | 0.839 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 1.0 - 1.4M Sodium Citrate |
