4ASB
The structure of modified benzoquinone ansamycins bound to yeast N- terminal Hsp90
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-10-28 |
Detector | ADSC CCD |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 74.460, 74.460, 110.860 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.650 - 3.080 |
R-factor | 0.17786 |
Rwork | 0.173 |
R-free | 0.26700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | IN-HOUSE MODEL |
RMSD bond length | 0.014 |
RMSD bond angle | 1.882 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.650 | 3.160 |
High resolution limit [Å] | 3.080 | 3.080 |
Rmerge | 0.150 | 0.660 |
Number of reflections | 6071 | |
<I/σ(I)> | 8.6 | 2.2 |
Completeness [%] | 98.9 | 100 |
Redundancy | 3.8 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | pH 7 |