9H4D
Crystal structure of IL-17A in complex with compound 18
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 | 2022-11-25 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.000015 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 64.601, 85.420, 120.161 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 51.520 - 2.117 |
| R-factor | 0.237 |
| Rwork | 0.237 |
| R-free | 0.24110 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.960 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | BUSTER |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.525 | 2.153 |
| High resolution limit [Å] | 2.117 | 2.117 |
| Rmerge | 0.047 | 3.904 |
| Rmeas | 0.050 | 4.104 |
| Rpim | 0.016 | 1.252 |
| Number of reflections | 18490 | 970 |
| <I/σ(I)> | 17.5 | 0.6 |
| Completeness [%] | 95.6 | 100 |
| Redundancy | 9.9 | 10.4 |
| CC(1/2) | 0.999 | 0.394 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | 0.1M citric acid pH 5.5 10% PEG 10000 12% iso-propanol 10% ethylene glycol |
