7HN3
PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z2301438417
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-05-24 |
| Detector | DECTRIS EIGER2 XE 9M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | I 4 |
| Unit cell lengths | 95.320, 95.320, 45.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 31.200 - 1.280 |
| R-factor | 0.1774 |
| Rwork | 0.176 |
| R-free | 0.19830 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.835 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.15) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 31.180 | 31.180 | 1.310 |
| High resolution limit [Å] | 1.280 | 5.720 | 1.280 |
| Rmerge | 0.056 | 0.031 | 1.189 |
| Rmeas | 0.059 | 0.032 | 1.371 |
| Rpim | 0.016 | 0.009 | 0.652 |
| Total number of observations | 568224 | 7962 | 12269 |
| Number of reflections | 51319 | 625 | 3051 |
| <I/σ(I)> | 19.1 | 67.4 | 1 |
| Completeness [%] | 97.0 | 99.5 | 77.8 |
| Redundancy | 11.1 | 12.7 | 4 |
| CC(1/2) | 1.000 | 0.999 | 0.357 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 4 % PEG 400, 2 M AmmSO4, 0.1 M HEPES pH 8 |
