7NEF
Fucosylated linear peptide Fln65 bound to the fucose binding lectin LecB PA-IIL from Pseudomonas aeruginosa at 1.5 Angstrom resolution
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-11-02 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 74.467, 64.300, 118.926 |
| Unit cell angles | 90.00, 94.91, 90.00 |
Refinement procedure
| Resolution | 48.590 - 1.510 |
| R-factor | 0.1833 |
| Rwork | 0.182 |
| R-free | 0.20600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1oxc |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.591 | 1.600 |
| High resolution limit [Å] | 1.507 | 1.510 |
| Rmeas | 0.117 | 0.933 |
| Number of reflections | 336482 | 50384 |
| <I/σ(I)> | 8.23 | 0.12 |
| Completeness [%] | 96.9 | 89.8 |
| Redundancy | 3.18 | 2.36 |
| CC(1/2) | 0.997 | 0.685 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M Magnesium formate dihydrate |
