1J95
KCSA potassium channel with TBA (tetrabutylammonium) and potassium
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID13 |
Synchrotron site | ESRF |
Beamline | ID13 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-01-01 |
Detector | MARRESEARCH |
Wavelength(s) | 0.964 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 128.900, 67.400, 112.000 |
Unit cell angles | 90.00, 125.30, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.800 |
R-factor | 0.32 |
Rwork | 0.298 |
R-free | 0.32200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1bl8 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.265 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.930 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.072 | 0.458 |
Number of reflections | 12054 | |
<I/σ(I)> | 11.3 | |
Completeness [%] | 92.6 | 93.1 |
Redundancy | 2.1 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 20 * | PEG 400, HEPES, POTASSIUM CHLORIDE, CALCIUM CHLORIDE, DETERGENT LDAO, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 5-10 (mg/ml) | |
2 | 1 | drop | 150 (mM) | ||
3 | 1 | drop | Tris | 50 (mM) | |
4 | 1 | drop | dithiothreitol | 2 (mM) | |
5 | 1 | reservoir | 200 (mM) | ||
6 | 1 | reservoir | HEPES | 100 (mM) | |
7 | 1 | reservoir | PEG400 | 48 (%) |