6QCI
Structure of XIAP-BIR1 V86E mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2017-12-15 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.8731 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 36.530, 72.700, 70.180 |
| Unit cell angles | 90.00, 96.16, 90.00 |
Refinement procedure
| Resolution | 36.350 - 2.300 |
| R-factor | 0.2656 |
| Rwork | 0.264 |
| R-free | 0.30320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4oxc |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.637 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.350 | 2.360 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Number of reflections | 16267 | |
| <I/σ(I)> | 4.4 | |
| Completeness [%] | 99.6 | |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Tris, pH 8.0, 0.2 M lithium sulphate, PEG 4000 |
