2X3T
Glutaraldehyde-crosslinked wheat germ agglutinin isolectin 1 crystal soaked with a synthetic glycopeptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.640, 93.210, 92.500 |
Unit cell angles | 90.00, 98.32, 90.00 |
Refinement procedure
Resolution | 32.653 - 2.749 |
R-factor | 0.2315 |
Rwork | 0.229 |
R-free | 0.28470 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7wga |
RMSD bond length | 0.002 |
RMSD bond angle | 0.721 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.910 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.100 | 0.490 |
Number of reflections | 19531 | |
<I/σ(I)> | 12.1 | 3.45 |
Completeness [%] | 99.5 | 99.2 |
Redundancy | 3.8 | 3.78 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.9 | 0.04M KH2PO4, 20% GLYCEROL, 14%-17% PEG 8000, pH 4.9 |