8JEO
Crystal structure of TIGIT in complexed with Tiragolumab
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL45XU |
Synchrotron site | SPring-8 |
Beamline | BL45XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-04-21 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.0 |
Spacegroup name | I 4 |
Unit cell lengths | 214.161, 214.161, 66.885 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.810 - 2.060 |
R-factor | 0.174 |
Rwork | 0.172 |
R-free | 0.20550 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.912 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.17.1_3660: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 151.400 | 10.000 | 2.180 |
High resolution limit [Å] | 2.060 | 6.130 | 2.060 |
Rmerge | 0.219 | 0.088 | 1.633 |
Rmeas | 0.239 | 0.096 | 1.791 |
Number of reflections | 94450 | 6978 | 29063 |
<I/σ(I)> | 6.2 | ||
Completeness [%] | 99.5 | ||
Redundancy | 6.2 | ||
CC(1/2) | 0.991 | 0.994 | 0.416 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M ammonium citrate tribasic pH 7.4, 14% PEG 3350 |