4OEV
Crystal structure of NikZ from Campylobacter jejuni in complex with Ni(II) ion
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-06-10 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97964 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 246.120, 47.860, 140.460 |
| Unit cell angles | 90.00, 114.60, 90.00 |
Refinement procedure
| Resolution | 45.235 - 1.900 |
| R-factor | 0.2036 |
| Rwork | 0.202 |
| R-free | 0.23550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4oet |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.407 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.240 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 117159 | |
| <I/σ(I)> | 13.65 | 3.14 |
| Completeness [%] | 99.0 | 99.7 |
| Redundancy | 4.6 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 20 % PEG 6000, 0.1 M MES pH 6.0 + NiCl2, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
