9BDO
Crystal structure of anti-abTCR NANOBODY VHH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-12-06 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0334 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 96.949, 70.725, 54.403 |
| Unit cell angles | 90.00, 94.86, 90.00 |
Refinement procedure
| Resolution | 57.060 - 1.948 |
| R-factor | 0.2127 |
| Rwork | 0.211 |
| R-free | 0.24150 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.000 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.11.7 (19-MAR-2020)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.120 | 2.000 |
| High resolution limit [Å] | 1.948 | 1.950 |
| Rmerge | 0.100 | 0.731 |
| Number of reflections | 26641 | 1953 |
| <I/σ(I)> | 4.2 | |
| Completeness [%] | 99.5 | 99.1 |
| Redundancy | 3.6 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.18 M Li2SO4, 10 mM trimethylTMamine, 90 mM NaAc (pH 4.4), and 27% (w/v) PEG8000. |
