2YKE
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 | IMAGE PLATE |
Collection date | 2004-11-19 |
Detector | MAR scanner 345 mm plate |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 66.440, 90.870, 98.820 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.350 - 1.430 |
R-factor | 0.169 |
Rwork | 0.168 |
R-free | 0.18520 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.110 |
Phasing software | AMoRE |
Refinement software | BUSTER (2.9.7) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.890 | 1.510 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.030 | 0.180 |
Number of reflections | 51677 | |
Completeness [%] | 94.1 | 91.7 |
Redundancy | 4 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | pH 7.5 |