7HMI
PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z1742054999
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 | 2024-07-10 |
| Detector | DECTRIS EIGER2 XE 9M |
| Wavelength(s) | 0.92134 |
| Spacegroup name | I 4 |
| Unit cell lengths | 95.630, 95.630, 45.892 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.620 - 1.420 |
| R-factor | 0.1865 |
| Rwork | 0.185 |
| R-free | 0.21510 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.648 |
| 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] | 67.610 | 67.610 | 1.440 |
| High resolution limit [Å] | 1.420 | 7.780 | 1.420 |
| Rmerge | 0.209 | 0.077 | 4.556 |
| Rmeas | 0.218 | 0.080 | 4.837 |
| Rpim | 0.060 | 0.024 | 1.614 |
| Total number of observations | 499362 | 3059 | 17139 |
| Number of reflections | 39275 | 265 | 1929 |
| <I/σ(I)> | 9.6 | 49.6 | 0.5 |
| Completeness [%] | 100.0 | 99.9 | 99.8 |
| Redundancy | 12.7 | 11.5 | 8.9 |
| CC(1/2) | 0.999 | 0.996 | 0.370 |
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 |
