3DUI
Crystal structure of the oxidized CG-1B: an adhesion/growth-regulatory lectin from chicken
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-10-05 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.95 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 71.590, 107.640, 35.830 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 25.350 - 2.100 |
R-factor | 0.238 |
Rwork | 0.238 |
R-free | 0.28600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1qmj |
RMSD bond length | 0.006 |
RMSD bond angle | 1.400 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.350 | 2.210 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.063 | 0.244 |
Number of reflections | 16792 | |
<I/σ(I)> | 6.9 | 2.9 |
Completeness [%] | 99.6 | 99.3 |
Redundancy | 5 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 30% (v/v) PEG 8000, 1% beta-mercaptoethanol, VAPOR DIFFUSION, HANGING DROP, temperature 298K |