5AVA
Crystal structure of PHA-E lectin in complex with bisected glycan
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2014-02-08 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 95.210, 122.838, 97.664 |
Unit cell angles | 90.00, 90.66, 90.00 |
Refinement procedure
Resolution | 100.000 - 3.000 |
R-factor | 0.23097 |
Rwork | 0.229 |
R-free | 0.27371 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3wcs |
RMSD bond length | 0.005 |
RMSD bond angle | 1.053 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 3.050 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.320 | |
Number of reflections | 45064 | |
<I/σ(I)> | 27.1 | 5.1 |
Completeness [%] | 99.9 | 100 |
Redundancy | 4.2 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 293 | 0.1M sodium acetate (pH 4.5), 25 %(w/v) PEG 3350 |