7HN1
PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z2065616520
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 | 95.450, 95.450, 45.780 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.770 - 1.470 |
| R-factor | 0.1965 |
| Rwork | 0.195 |
| R-free | 0.22900 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.564 |
| 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] | 33.750 | 33.750 | 1.510 |
| High resolution limit [Å] | 1.470 | 6.570 | 1.470 |
| Rmerge | 0.226 | 0.082 | 3.199 |
| Rmeas | 0.235 | 0.086 | 3.392 |
| Rpim | 0.064 | 0.024 | 1.107 |
| Total number of observations | 441665 | 5206 | 23176 |
| Number of reflections | 35195 | 421 | 2576 |
| <I/σ(I)> | 8.3 | 30.1 | 0.8 |
| Completeness [%] | 100.0 | 99.1 | 100 |
| Redundancy | 12.5 | 12.4 | 9 |
| CC(1/2) | 0.997 | 0.997 | 0.378 |
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 |
