4UP4
Structure of the recombinant lectin PVL from Psathyrella velutina in complex with GlcNAcb-D-1,3Galactoside
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 | 2014-04-07 |
Detector | MARRESEARCH |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.814, 97.468, 158.650 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.950 |
R-factor | 0.19231 |
Rwork | 0.190 |
R-free | 0.23694 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2c4d |
RMSD bond length | 0.016 |
RMSD bond angle | 1.692 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.000 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.100 | 0.400 |
Number of reflections | 62754 | |
<I/σ(I)> | 11.8 | 3.1 |
Completeness [%] | 99.8 | 98.3 |
Redundancy | 5.2 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 20% PEG3350, 0.2M SODIUM FORMATE, 0.1M DIAMMONIUM PHOSPHATE |