4MLE
Human Glucokinase in Complex with Novel Amino Thiazole Activator
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.54 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 79.320, 79.320, 320.210 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.000 - 2.600 |
Rwork | 0.242 |
R-free | 0.28900 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.065 |
RMSD bond angle | 1.270 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.740 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.043 | 0.305 |
Number of reflections | 18608 | |
<I/σ(I)> | 12.1 | 2.6 |
Completeness [%] | 96.2 | 89 |
Redundancy | 7.2 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | PEG1500, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |