8OMK
hKHK-C in complex with ADP & fructose 1-phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | RIGAKU MICROMAX-003 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-02-05 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.541780 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 82.809, 85.818, 137.240 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.640 - 2.480 |
R-factor | 0.201 |
Rwork | 0.200 |
R-free | 0.21900 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.060 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | BALBES |
Refinement software | BUSTER |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 85.800 | 2.485 |
High resolution limit [Å] | 2.477 | 2.477 |
Rmerge | 0.088 | 0.719 |
Rpim | 0.047 | 0.423 |
Number of reflections | 34361 | 309 |
<I/σ(I)> | 15.2 | 2.1 |
Completeness [%] | 96.7 | 87.3 |
Redundancy | 6.6 | |
CC(1/2) | 1.000 | 0.873 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 277 | 2 M ammonium sulphate |