4EDY
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 | P 1 21 1 |
| Unit cell lengths | 48.685, 78.099, 52.585 |
| Unit cell angles | 90.00, 91.74, 90.00 |
Refinement procedure
| Resolution | 19.520 - 1.720 |
| R-factor | 0.17602 |
| Rwork | 0.175 |
| R-free | 0.20437 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.828 |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 20.000 | 20.000 | 1.780 |
| High resolution limit [Å] | 1.720 | 3.700 | 1.720 |
| Rmerge | 0.033 | 0.230 | 0.670 |
| Number of reflections | 40679 | ||
| <I/σ(I)> | 18.9 | ||
| Completeness [%] | 97.5 | 97.5 | 90.2 |
| Redundancy | 3.8 | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | vapor diffusion |
