9SQX
Crystal structure of IL-17A in complex with compound 19
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-10-31 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.918808 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 61.236, 59.069, 71.101 |
| Unit cell angles | 90.00, 101.73, 90.00 |
Refinement procedure
| Resolution | 20.480 - 1.413 |
| R-factor | 0.2078 |
| Rwork | 0.207 |
| R-free | 0.22670 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.190 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.040 | 1.437 |
| High resolution limit [Å] | 1.413 | 1.413 |
| Rmerge | 0.033 | 2.065 |
| Rmeas | 0.036 | 2.261 |
| Rpim | 0.016 | 1.028 |
| Number of reflections | 95120 | 4735 |
| <I/σ(I)> | 16.2 | 0.6 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 5.2 | 4.9 |
| CC(1/2) | 1.000 | 0.398 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 0.2M lithium sulfate 0.1M Bis-Tris pH 5.5 25% PEG 3,350 |
