6TF7
Human galectin-3c in complex with a galactose derivative
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-2 |
Synchrotron site | MAX II |
Beamline | I911-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-03-27 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.03841 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 36.140, 58.160, 62.840 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.080 - 1.400 |
R-factor | 0.1374 |
Rwork | 0.135 |
R-free | 0.18720 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zsl |
RMSD bond length | 0.019 |
RMSD bond angle | 2.184 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | REFMAC (5) |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.080 | 1.440 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.048 | 0.519 |
Number of reflections | 26601 | 1923 |
<I/σ(I)> | 24 | |
Completeness [%] | 99.6 | |
Redundancy | 5.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 300 | 20 MG/ML GALECTIN-3C, 100MM NACL, 30 % W/V PEG 4000, 0.4 M NASCN, 10 MM BETA-MERCAPTOETHANOL, 10 MM PHOSHATE, 100 MM MGCL2, 100 MM TRIS/HCL PH 7.5, 4.5 MM LIGAND |