8H3X
Bacteroide Fragilis Toxin in complex with nanobody 282
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-11-27 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 55.663, 78.212, 118.132 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.170 - 1.660 |
| R-factor | 0.1843 |
| Rwork | 0.183 |
| R-free | 0.21640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3p24 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.040 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.19) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.170 | 1.720 |
| High resolution limit [Å] | 1.660 | 1.660 |
| Number of reflections | 117825 | 5862 |
| <I/σ(I)> | 21.83 | |
| Completeness [%] | 99.5 | |
| Redundancy | 12.3 | |
| CC(1/2) | 1.000 | 0.529 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M Potassium thiocyanate, 20 % w/v PEG 3350 |
