6EF6
Structure of the microcompartment-associated aminopropanol kinase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-01-20 |
Detector | DECTRIS PILATUS3 X 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 72.010, 70.050, 60.720 |
Unit cell angles | 90.00, 95.12, 90.00 |
Refinement procedure
Resolution | 39.828 - 1.350 |
R-factor | 0.1498 |
Rwork | 0.149 |
R-free | 0.16750 |
Structure solution method | SAD |
RMSD bond length | 0.011 |
RMSD bond angle | 1.164 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.390 |
High resolution limit [Å] | 1.350 | 1.350 |
Number of reflections | 65639 | 4820 |
<I/σ(I)> | 11 | 2.04 |
Completeness [%] | 99.6 | 98.4 |
Redundancy | 3.3 | 2.8 |
CC(1/2) | 0.747 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 1.1 M sodium malonate, 0.1 M HEPES pH 7, 0.5% (v/v) Jeffamine E.D. 2001, 30 mg/ml protein, serial seeding with 1/1000 diluted crushed crystals |