4NDV
Crystal structure of L. decastes alpha-galactosyl-binding lectin in complex with globotriose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-07 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.934 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.870, 56.790, 44.500 |
| Unit cell angles | 90.00, 107.07, 90.00 |
Refinement procedure
| Resolution | 19.641 - 1.300 |
| R-factor | 0.1235 |
| Rwork | 0.122 |
| R-free | 0.15550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4nds |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.233 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.300 | |
| High resolution limit [Å] | 1.230 | 3.660 | 1.230 |
| Rmerge | 0.019 | 0.012 | 0.212 |
| Number of reflections | 35328 | 3014 | 2861 |
| <I/σ(I)> | 26.37 | 61.68 | 2.92 |
| Completeness [%] | 71.2 | 83.2 | 18.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.2 M calcium chloride, 0.1 M HEPES sodium, 28% v/v PEG400, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
