9W6S
hCA450-21.1 Fab and GD2 complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-03-06 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97861 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 75.480, 109.190, 170.210 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.553 - 1.690 |
| Rwork | 0.181 |
| R-free | 0.20530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.866 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0430 (refmacat 0.4.100)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.553 | 1.734 |
| High resolution limit [Å] | 1.690 | 1.690 |
| Rmerge | 0.200 | 0.293 |
| Number of reflections | 157524 | 10982 |
| <I/σ(I)> | 9 | |
| Completeness [%] | 100.0 | |
| Redundancy | 12.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291.15 | 0.1 M HEPES sodium (pH 7.5), 1% (v/v) polyethylene glycol 400 (PEG 400), and 2.2 M ammonium |
