3C22
Crystal structure of the carbohydrate recognition domain of human Langerin
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 | 2007-09-13 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97966 |
Spacegroup name | P 42 |
Unit cell lengths | 79.555, 79.555, 90.144 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.720 - 1.500 |
R-factor | 0.192 |
Rwork | 0.189 |
R-free | 0.23600 |
Structure solution method | MIRAS |
RMSD bond length | 0.014 |
RMSD bond angle | 1.516 |
Data reduction software | XDS |
Phasing software | autoSHARP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.590 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.044 | 0.331 |
Number of reflections | 89721 | |
<I/σ(I)> | 25.4 | 6.1 |
Completeness [%] | 99.4 | 98.7 |
Redundancy | 7.2 | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 400mM MgCl2, 25% PEG 3350, 100mM HEPES pH 7, VAPOR DIFFUSION, HANGING DROP, temperature 293K |