8EA8
NKG2D complexed with inhibitor 4a
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-03-25 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 100.090, 43.675, 72.591 |
| Unit cell angles | 90.00, 125.01, 90.00 |
Refinement procedure
| Resolution | 37.250 - 1.770 |
| R-factor | 0.1636 |
| Rwork | 0.162 |
| R-free | 0.20000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mpu |
| Data reduction software | DIALS |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 59.460 | 59.490 | 1.800 |
| High resolution limit [Å] | 1.770 | 4.800 | 1.770 |
| Rmeas | 0.068 | 0.045 | 0.236 |
| Rpim | 0.037 | 0.024 | 0.129 |
| Total number of observations | 82281 | 4516 | 2619 |
| Number of reflections | 24445 | 1332 | 912 |
| <I/σ(I)> | 12.2 | 20.1 | 4.4 |
| Completeness [%] | 96.7 | 99.8 | 74.8 |
| Redundancy | 3.4 | 3.4 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.15 - 0.22 M NaNO3, 20- 31 % (w/v) PEG 3350 |
