9CCF
Crystal Structure of DA7-2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-10-19 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 1.00002 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.423, 67.214, 68.361 |
| Unit cell angles | 90.00, 96.75, 90.00 |
Refinement procedure
| Resolution | 47.760 - 4.000 |
| R-factor | 0.2423 |
| Rwork | 0.236 |
| R-free | 0.29630 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.429 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.1_5286) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.760 | 4.470 |
| High resolution limit [Å] | 4.000 | 4.000 |
| Rmerge | 0.047 | 0.118 |
| Rpim | 0.047 | |
| Number of reflections | 3361 | 941 |
| <I/σ(I)> | 11.5 | 6.5 |
| Completeness [%] | 99.5 | 99.8 |
| Redundancy | 5 | 5.1 |
| CC(1/2) | 0.997 | 0.979 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293 | 0.1 M Sodium acetate pH 4.6 and 25% (v/v) PEG 550 MME |
