8S6K
Crystal structure of ScFv-G2D11 complexed to a bis-Tn glycopeptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-12-09 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.9999 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.992, 69.667, 87.367 |
| Unit cell angles | 90.00, 102.99, 90.00 |
Refinement procedure
| Resolution | 19.900 - 1.750 |
| R-factor | 0.18396 |
| Rwork | 0.182 |
| R-free | 0.22142 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.945 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.085 | 0.489 |
| Number of reflections | 52287 | 6651 |
| <I/σ(I)> | 7.3 | 1.7 |
| Completeness [%] | 96.5 | 84.6 |
| Redundancy | 3.5 | |
| CC(1/2) | 0.996 | 0.778 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 291 | lithium chloride Tris PEG 8000 |
