7HLG
PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z2365130785
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 | 2024-05-22 |
| Detector | DECTRIS EIGER2 XE 9M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | I 4 |
| Unit cell lengths | 96.084, 96.084, 45.574 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.990 - 1.500 |
| R-factor | 0.1864 |
| Rwork | 0.185 |
| R-free | 0.20790 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.645 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.7) |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 33.970 | 33.970 | 1.530 |
| High resolution limit [Å] | 1.500 | 8.220 | 1.500 |
| Rmerge | 0.157 | 0.055 | 3.705 |
| Rmeas | 0.163 | 0.058 | 3.899 |
| Rpim | 0.044 | 0.017 | 1.208 |
| Total number of observations | 444419 | 2606 | 17448 |
| Number of reflections | 33453 | 225 | 1687 |
| <I/σ(I)> | 10.6 | 62.4 | 0.4 |
| Completeness [%] | 100.0 | 98.9 | 100 |
| Redundancy | 13.3 | 11.6 | 10.3 |
| CC(1/2) | 0.996 | 0.998 | 0.296 |
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 |
