8CDB
Proulilysin E229A structure
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 | 2021-05-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 192.100, 544.400, 185.500 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 94.720 - 4.500 |
| R-factor | 0.2896 |
| Rwork | 0.289 |
| R-free | 0.30210 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.875 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20_4459) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 94.720 | 4.500 |
| High resolution limit [Å] | 4.500 | 4.500 |
| Rmeas | 0.314 | 0.314 |
| Number of reflections | 57826 | 57250 |
| <I/σ(I)> | 5.3 | |
| Completeness [%] | 99.5 | |
| Redundancy | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 100 mM sodium acetate pH 4.5, 1 M diammonium hydrogen phosphate, 10 mM AEBSF |
