4NRN
Crystal structure of metal-bound toxin from Helicobacter pylori
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Detector technology | CCD |
Collection date | 2011-11-24 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.012, 47.028, 52.599 |
Unit cell angles | 90.00, 110.01, 90.00 |
Refinement procedure
Resolution | 21.876 - 1.802 |
R-factor | 0.1823 |
Rwork | 0.180 |
R-free | 0.22560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4ls4 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.096 |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 14014 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 277 | polyethylene glycol 3350, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 277.0K |