9H9B
native structure of the full-length pesticidal protein Cry8Ba2, from crystals formed in vivo (form 2)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | EUROPEAN XFEL BEAMLINE SPB/SFX |
| Synchrotron site | European XFEL |
| Beamline | SPB/SFX |
| Temperature [K] | 298 |
| Detector technology | PIXEL |
| Collection date | 2022-05-09 |
| Detector | AGIPD |
| Wavelength(s) | 1.33 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 93.320, 93.320, 275.510 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.110 - 2.270 |
| R-factor | 0.18244 |
| Rwork | 0.180 |
| R-free | 0.22585 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.577 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.170 | 2.230 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 61661 | 2918 |
| <I/σ(I)> | 6 | 0.74 |
| Completeness [%] | 98.0 | |
| Redundancy | 226.21 | |
| CC(1/2) | 0.987 | 0.088 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | IN CELL | 7 | 298 | Natural conditions |
