4Z4Z
Crystal structure of GII.10 P domain in complex with 30mM B antigen (trisaccharide)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-02-20 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.984463 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.830, 78.293, 71.630 |
Unit cell angles | 90.00, 103.35, 90.00 |
Refinement procedure
Resolution | 42.860 - 1.801 |
R-factor | 0.1652 |
Rwork | 0.164 |
R-free | 0.19260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3onu |
RMSD bond length | 0.007 |
RMSD bond angle | 1.061 |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.860 | 1.865 |
High resolution limit [Å] | 1.800 | 1.801 |
Rmerge | 0.069 | |
Number of reflections | 65787 | |
<I/σ(I)> | 11.57 | 2.14 |
Completeness [%] | 98.9 | 95.13 |
Redundancy | 3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | sodium nitrate, bis-tris propane, PEG3350 |