8C8E
Crystal structure of phi3T_93 L23D mutant
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 | 2022-06-17 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 71.890, 71.890, 68.341 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 62.260 - 2.200 |
| R-factor | 0.2112 |
| Rwork | 0.210 |
| R-free | 0.23840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.892 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHENIX (1.20_4459) |
| Refinement software | PHENIX (1.20_4459) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.260 | 2.270 |
| High resolution limit [Å] | 2.199 | 2.200 |
| Rmerge | 0.117 | 1.119 |
| Rmeas | 0.124 | |
| Rpim | 0.041 | |
| Number of reflections | 10758 | 912 |
| <I/σ(I)> | 15 | 3.1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 16.7 | 14.4 |
| CC(1/2) | 0.998 | 0.904 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 294.15 | 18% w/vPEG 8000, 100mM HEPES Sodium Salt, 200mM calcium acetate |
