4EDZ
Crystal structure of hH-PGDS with water displacing inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Detector technology | CCD |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.5418 |
Spacegroup name | I 41 |
Unit cell lengths | 124.468, 124.468, 105.927 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.000 |
R-factor | 0.1919 |
Rwork | 0.190 |
R-free | 0.23600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.977 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Rmerge | 0.095 | 0.069 | 0.307 |
Number of reflections | 49416 | ||
<I/σ(I)> | 5.8 | ||
Completeness [%] | 90.3 | 84.6 | 89 |
Redundancy | 2.1 | 2.5 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | vapor diffusion |