4Z42
Crystal structure of urease from Yersinia enterocolitica
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-07-27 |
| Detector | RIGAKU SATURN 944+ |
| Wavelength(s) | 1.54187 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 157.200, 157.200, 774.620 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 29.710 - 3.010 |
| R-factor | 0.278 |
| Rwork | 0.277 |
| R-free | 0.29760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1fwb |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.940 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.300 | 3.190 |
| High resolution limit [Å] | 3.010 | 3.010 |
| Rmerge | 0.061 | 1.480 |
| Number of reflections | 84998 | |
| <I/σ(I)> | 8.5 | 1.8 |
| Completeness [%] | 99.6 | 96.4 |
| Redundancy | 4.7 | 10.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.2M MgCl2, 0.1M Sodium HEPES pH 7.5, 30%(v/v) PEG 400 |
