2YK2
Tricyclic series of Hsp90 inhibitors
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-06 |
Detector | MARRESEARCH |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 66.608, 99.103, 90.873 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.850 - 1.740 |
R-factor | 0.183 |
Rwork | 0.181 |
R-free | 0.21110 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.010 |
Phasing software | AMoRE |
Refinement software | BUSTER (2.9.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 14.850 | 1.800 |
High resolution limit [Å] | 1.740 | 1.740 |
Rmerge | 0.070 | 0.380 |
Number of reflections | 30793 | |
Completeness [%] | 98.6 | 90.9 |
Redundancy | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | pH 7.5 |