8BGB
Structure of the citrate-bound extracytoplasmic PAS domain of histidine kinase CitA from Geobacillus thermodenitrificans
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-05-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 64.209, 101.140, 77.877 |
Unit cell angles | 90.00, 105.63, 90.00 |
Refinement procedure
Resolution | 48.790 - 1.700 |
Rwork | 0.167 |
R-free | 0.19580 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2j80 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.650 |
Data reduction software | XDS |
Data scaling software | SADABS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.790 | 1.730 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmeas | 0.049 | 0.295 |
Number of reflections | 105114 | 3571 |
<I/σ(I)> | 16.47 | |
Completeness [%] | 98.9 | |
Redundancy | 6.85 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 293 | 1 M tri-sodium citrate, pH 9.0, 0.1 M imidazole |