6SP4
KEAP1 IN COMPLEX WITH COMPOUND 23
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-10-14 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.00000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 112.452, 91.875, 112.313 |
Unit cell angles | 90.00, 119.89, 90.00 |
Refinement procedure
Resolution | 47.990 - 2.590 |
R-factor | 0.1757 |
Rwork | 0.175 |
R-free | 0.22470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | NONE |
RMSD bond length | 0.008 |
RMSD bond angle | 1.256 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.990 | 2.805 |
High resolution limit [Å] | 2.590 | 2.600 |
Rmerge | 0.083 | 0.431 |
Number of reflections | 59516 | 12142 |
<I/σ(I)> | 10.8 | 2.69 |
Completeness [%] | 97.0 | 97.8 |
Redundancy | 2.9 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | ammonium acetate |