3WIW
Crystal structure of unsaturated glucuronyl hydrolase specific for heparin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL38B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL38B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-04-17 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 91.840, 50.960, 85.816 |
| Unit cell angles | 90.00, 115.73, 90.00 |
Refinement procedure
| Resolution | 45.634 - 1.350 |
| R-factor | 0.1325 |
| Rwork | 0.132 |
| R-free | 0.15980 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zzr |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.226 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.400 |
| High resolution limit [Å] | 1.350 | 1.350 |
| Rmerge | 0.091 | 0.367 |
| Number of reflections | 78862 | |
| <I/σ(I)> | 32.5 | 3.72 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 4.7 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 25% PEG6000, 0.1M HEPES-Na, 0.1M lithium chloride, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
