4LBM
Crystal structure of Human galectin-3 CRD in complex with LNT
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | MACSCIENCE |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2008-06-23 |
Detector | BRUKER SMART 6000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 36.664, 58.131, 63.612 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.910 - 1.550 |
R-factor | 0.148 |
Rwork | 0.147 |
R-free | 0.17100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1a3k |
RMSD bond length | 0.008 |
RMSD bond angle | 1.427 |
Data reduction software | SAINT |
Data scaling software | SAINT |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.912 | 1.630 |
High resolution limit [Å] | 1.496 | 1.550 |
Rmerge | 0.128 | |
Number of reflections | 19413 | |
<I/σ(I)> | 22.8 | 5.7 |
Completeness [%] | 95.0 | 71 |
Redundancy | 5.7 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 31% PEG 6000, 100MM MGCL2, 8MM BETA MERCEPTOETHANOL, 100MM TRIS HCL, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |