5CF0
Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ6
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-08-06 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9792 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 70.267, 88.300, 96.993 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.370 - 1.800 |
R-factor | 0.1973 |
Rwork | 0.195 |
R-free | 0.22210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3t0z |
RMSD bond length | 0.006 |
RMSD bond angle | 1.005 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.6.2_432) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.370 |
High resolution limit [Å] | 1.700 |
Number of reflections | 33536 |
<I/σ(I)> | 36.4 |
Completeness [%] | 94.2 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 100 mM Tris-HCl, 20% PEG 4000, 200 mM MgCl2 |