7OLU
Structure of the N-terminal domain of BC2L-C lectin (1-131) in complex with a synthetic beta-C-fucoside ligand
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-09-05 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.980 |
| Spacegroup name | P 63 |
| Unit cell lengths | 43.954, 43.954, 94.138 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 38.065 - 1.793 |
| Rwork | 0.140 |
| R-free | 0.19420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wq4 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.825 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.070 | 1.830 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Rmerge | 0.039 | 0.228 |
| Rmeas | 0.041 | 0.241 |
| Rpim | 0.013 | 0.077 |
| Number of reflections | 9696 | 563 |
| <I/σ(I)> | 49.1 | 11.1 |
| Completeness [%] | 99.7 | 95.4 |
| Redundancy | 20.2 | 17.2 |
| CC(1/2) | 1.000 | 0.990 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 292 | sodium citrate 1.2M |
