3FZK
Crystal Structures of Hsc70/Bag1 in Complex with Small Molecule Inhibitors
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-06-20 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 40.504, 119.896, 53.047 |
Unit cell angles | 90.00, 106.52, 90.00 |
Refinement procedure
Resolution | 24.850 - 2.100 |
R-factor | 0.22178 |
Rwork | 0.215 |
R-free | 0.29434 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hx1 |
RMSD bond length | 0.020 |
RMSD bond angle | 1.922 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.850 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.101 | 0.440 |
Number of reflections | 31695 | |
<I/σ(I)> | 3.4 | 1.3 |
Completeness [%] | 96.1 | 90.4 |
Redundancy | 2.43 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 15% PEG3350, 0.1M Tris buffer, 25mM sodium-potassium tartrate, pH8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |