5LR7
CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH SAR567530
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-10-04 |
Detector | MARRESEARCH |
Wavelength(s) | 1.54 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 66.628, 98.223, 90.539 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.940 - 1.860 |
R-factor | 0.165 |
Rwork | 0.163 |
R-free | 0.20100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yjx |
RMSD bond length | 0.010 |
RMSD bond angle | 0.980 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.270 | 1.900 |
High resolution limit [Å] | 1.860 | 1.860 |
Rmerge | 0.272 | |
Number of reflections | 24806 | |
<I/σ(I)> | 13.4 | 4.5 |
Completeness [%] | 97.3 | 64.5 |
Redundancy | 4.6 | 3.9 |
CC(1/2) | 0.902 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 1.0 - 1.4M Sodium Citrate |