8GH7
142D6 bound to BIR3-XIAP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-03-16 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | .97934 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 34.171, 55.150, 93.033 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.560 - 1.750 |
| R-factor | 0.1791 |
| Rwork | 0.177 |
| R-free | 0.20910 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.644 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER (2.8.3) |
| Refinement software | PHENIX (1.19.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmeas | 0.158 | 0.763 |
| Rpim | 0.059 | |
| Number of reflections | 18803 | 1695 |
| <I/σ(I)> | 13.4 | |
| Completeness [%] | 98.9 | 98.9 |
| Redundancy | 3.6 | 5.7 |
| CC(1/2) | 0.972 | 0.846 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1 M HEPES pH 7.5, 35% isopropanol and 18% PEG 4000 |
