9I4K
Galectin-1 in Complex with Methyl 6-fluoro-N-acetyllactosaminide
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-10-08 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9184 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.785, 58.757, 112.135 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.017 - 1.631 |
| Rwork | 0.218 |
| R-free | 0.26400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.771 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.8.0430 (refmacat 0.4.88)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.017 | 1.730 |
| High resolution limit [Å] | 1.631 | 1.631 |
| Rmeas | 0.118 | 1.637 |
| Number of reflections | 35961 | 5155 |
| <I/σ(I)> | 10.62 | 0.96 |
| Completeness [%] | 95.3 | 85.6 |
| Redundancy | 9.2 | 7.7 |
| CC(1/2) | 0.998 | 0.575 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 291 | 0.1M Tris-Cl, pH8, 0.2M lithium sulfate, 30% PEG 3350 |
