4YM3
Crystal structure of the human galectin-4 C-terminal carbohydrate recognition domain in complex with lactose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-15 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9713 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.533, 130.185, 45.465 |
| Unit cell angles | 90.00, 96.91, 90.00 |
Refinement procedure
| Resolution | 45.200 - 1.890 |
| R-factor | 0.1688 |
| Rwork | 0.167 |
| R-free | 0.19590 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ojb |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.296 |
| Data reduction software | XDS |
| Data scaling software | SCALA (3.3.21) |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 65.092 | 45.202 | 1.980 |
| High resolution limit [Å] | 1.889 | 5.930 | 1.870 |
| Rmerge | 0.144 | 0.515 | |
| Rmeas | 0.202 | ||
| Rpim | 0.053 | 0.037 | 0.201 |
| Total number of observations | 500962 | 23223 | 33268 |
| Number of reflections | 41495 | ||
| <I/σ(I)> | 15.8 | 42.3 | 4.8 |
| Completeness [%] | 98.9 | 99.8 | 91.5 |
| Redundancy | 12.1 | 16.6 | 7.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293.15 | 1.2 M Ammonium sulfate, 0.1 M HEPES pH 7.0, 4 % v/v PEG 400 |
