4XTM
Crystal structure of a recombinant Vatairea macrocarpa seed lectin complexed with GalNAc
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-12-13 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.915 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 56.354, 86.111, 129.023 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.150 - 2.700 |
R-factor | 0.207 |
Rwork | 0.205 |
R-free | 0.24400 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.396 |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.2.7) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.150 | 2.830 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.111 | 0.394 |
Number of reflections | 7221 | |
<I/σ(I)> | 6.4 | 2.3 |
Completeness [%] | 81.7 | 84.8 |
Redundancy | 3.1 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 3.5 | 293 |