7HMH
PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z1636723439
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 | 95.500, 95.500, 45.840 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.360 - 1.500 |
| R-factor | 0.1901 |
| Rwork | 0.189 |
| R-free | 0.21340 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.668 |
| 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] | 41.330 | 41.330 | 1.540 |
| High resolution limit [Å] | 1.500 | 6.710 | 1.500 |
| Rmerge | 0.236 | 0.061 | 3.049 |
| Rmeas | 0.246 | 0.064 | 3.206 |
| Rpim | 0.067 | 0.019 | 0.982 |
| Total number of observations | 438729 | 4758 | 26065 |
| Number of reflections | 33253 | 405 | 2472 |
| <I/σ(I)> | 10.9 | 40 | 0.8 |
| Completeness [%] | 100.0 | 99.7 | 100 |
| Redundancy | 13.2 | 11.7 | 10.5 |
| CC(1/2) | 0.997 | 0.980 | 0.342 |
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 |
