8ANU
Crystal structure of protein phi3T-93
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-10-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 46.350, 49.910, 70.530 |
| Unit cell angles | 90.00, 107.74, 90.00 |
Refinement procedure
| Resolution | 40.063 - 2.310 |
| R-factor | 0.211675325209 |
| Rwork | 0.209 |
| R-free | 0.26035 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 8ant |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.159 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.470 | 2.440 |
| High resolution limit [Å] | 2.310 | 2.310 |
| Rmerge | 0.100 | 0.212 |
| Rmeas | 0.237 | |
| Rpim | 0.102 | |
| Number of reflections | 6697 | 985 |
| <I/σ(I)> | 8.5 | 4.4 |
| Completeness [%] | 98.1 | 98.6 |
| Redundancy | 4.9 | 5.1 |
| CC(1/2) | 0.993 | 0.961 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294.15 | 10%PEG8000, 50mM magnesium acetate, 100mM sodium acetate |
