5OCI
Human Heat Shock Protein 90 bound to 6-Hydroxy-3-(3-methyl-benzyl)-1H-indazole-5-carboxylic acid methyl-(4-morpholin-4-yl-phenyl)-amide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2009-05-01 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.00000 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 67.476, 90.607, 99.211 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 13.940 - 1.620 |
R-factor | 0.209 |
Rwork | 0.208 |
R-free | 0.22500 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.050 |
Data reduction software | XDS |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.7) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 21.900 |
High resolution limit [Å] | 1.620 |
Number of reflections | 36926 |
<I/σ(I)> | 51.3 |
Completeness [%] | 96.5 |
Redundancy | 5.13 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | Na-Cacodylate, pH 6.5 28% PEG8000 0,2 M NH4-Sulfate |