5J9P
KcsA in vitro
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 4.2.2 |
Synchrotron site | ALS |
Beamline | 4.2.2 |
Temperature [K] | 80 |
Detector technology | CMOS |
Collection date | 2014-02-09 |
Detector | RDI CMOS_8M |
Wavelength(s) | 1 |
Spacegroup name | I 4 |
Unit cell lengths | 155.695, 155.695, 74.791 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.638 - 2.850 |
R-factor | 0.2216 |
Rwork | 0.217 |
R-free | 0.26640 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.480 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.21) |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.962 | 50.962 | 3.000 |
High resolution limit [Å] | 2.850 | 9.010 | 2.850 |
Rmerge | 0.034 | 1.976 | |
Rmeas | 0.202 | 0.037 | 2.132 |
Rpim | 0.073 | 0.014 | 0.793 |
Total number of observations | 160009 | 5023 | 22269 |
Number of reflections | 21104 | ||
<I/σ(I)> | 11.7 | 47.3 | 1.1 |
Completeness [%] | 100.0 | 99.6 | 100 |
Redundancy | 7.6 | 7.1 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG400 |