2XJJ
Structure of HSP90 with small molecule inhibitor bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Temperature [K] | 100 |
Spacegroup name | P 1 |
Unit cell lengths | 39.326, 56.098, 61.607 |
Unit cell angles | 82.59, 84.71, 69.24 |
Refinement procedure
Resolution | 36.600 - 1.900 |
R-factor | 0.1857 |
Rwork | 0.183 |
R-free | 0.23250 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.013 |
RMSD bond angle | 1.150 |
Refinement software | BUSTER-TNT (2.9.2) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.600 |
High resolution limit [Å] | 1.900 |
Rmerge | 0.050 |
Number of reflections | 38441 |
Completeness [%] | 91.1 |
Redundancy | 3.34 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |