4F9O
Crystal Structure of recombinant human Hexokinase type I with 2-deoxy-Glucose 6-Phosphate
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] | 100 |
Detector technology | CCD |
Detector | NOIR-1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 82.980, 122.090, 120.350 |
Unit cell angles | 90.00, 92.97, 90.00 |
Refinement procedure
Resolution | 35.360 - 2.650 |
R-factor | 0.2406 |
Rwork | 0.240 |
R-free | 0.25780 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.865 |
Data reduction software | d*TREK (9.7L) |
Data scaling software | d*TREK |
Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.360 | 35.360 | 2.740 |
High resolution limit [Å] | 2.650 | 5.700 | 2.650 |
Rmerge | 0.086 | 0.054 | 0.293 |
Total number of observations | 26627 | 25768 | |
Number of reflections | 69139 | ||
<I/σ(I)> | 8.4 | 16.2 | 3.3 |
Completeness [%] | 99.3 | 98.8 | 99 |
Redundancy | 3.82 | 3.79 | 3.71 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | hanging drop | 6 | 277 | PEG 4000, PEG 8000, sodium acetate, sodium citrate, pH 6.0, hanging drop, temperature 277K |