6ADC
Crystal structure of the E148A mutant CLC-ec1 in the presence of 50mM bromoacetate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 5C (4A) |
Synchrotron site | PAL/PLS |
Beamline | 5C (4A) |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2018-06-12 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.919 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 233.249, 96.732, 169.779 |
Unit cell angles | 90.00, 131.45, 90.00 |
Refinement procedure
Resolution | 34.852 - 3.055 |
R-factor | 0.2281 |
Rwork | 0.226 |
R-free | 0.27470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ene |
RMSD bond length | 0.010 |
RMSD bond angle | 1.302 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.900 | 3.160 |
High resolution limit [Å] | 3.055 | 3.050 |
Rmerge | 0.150 | 1.330 |
Number of reflections | 102941 | 10254 |
<I/σ(I)> | 32.1 | 1.6 |
Completeness [%] | 99.4 | 99.3 |
Redundancy | 7.5 | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 295 | PEG400 24% (w/v), 100mM glycine, 20 mM Na/K tartrate, 50 mM bromoacetate |