3QDS
Structure of apo Boletus edulis lectin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-08 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 68.047, 97.443, 84.366 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.300 - 1.150 |
R-factor | 0.17439 |
Rwork | 0.174 |
R-free | 0.18745 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qdw |
RMSD bond length | 0.012 |
RMSD bond angle | 1.479 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.300 | 1.210 |
High resolution limit [Å] | 1.150 | 1.150 |
Rmerge | 0.070 | 0.177 |
Number of reflections | 95942 | |
<I/σ(I)> | 16.5 | 6.9 |
Completeness [%] | 96.8 | 89.5 |
Redundancy | 4.6 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 1.6M ammonium sulphate, 0.05M MES, 10% dioxane, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |