9PGZ
X-ray crystal structure of SRD42
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE 7B2 |
| Synchrotron site | CHESS |
| Beamline | 7B2 |
| Temperature [K] | 81 |
| Detector technology | PIXEL |
| Collection date | 2024-11-08 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 0.96860 |
| Spacegroup name | P 43 3 2 |
| Unit cell lengths | 150.264, 150.264, 150.264 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.566 - 2.600 |
| R-factor | 0.19856 |
| Rwork | 0.196 |
| R-free | 0.24690 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.459 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0430) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.566 | 2.609 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.128 | 1.408 |
| Number of reflections | 18413 | 185 |
| <I/σ(I)> | 23.6 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 27.5 | |
| CC(1/2) | 1.000 | 0.699 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 279 | 0.5 M Sodium chloride, 0.01 M Hexadecyltrimethylammonium bromide |
