6GHA
USP15 catalytic domain structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-11-19 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.966 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.505, 62.621, 62.043 |
| Unit cell angles | 90.00, 104.97, 90.00 |
Refinement procedure
| Resolution | 35.248 - 1.980 |
| R-factor | 0.1997 |
| Rwork | 0.198 |
| R-free | 0.23440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2y6e |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.6.2) |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 46.860 | 46.860 | 2.020 |
| High resolution limit [Å] | 1.970 | 9.020 | 1.970 |
| Rmerge | 0.111 | 0.061 | 1.060 |
| Rmeas | 0.134 | 0.072 | 1.281 |
| Rpim | 0.074 | 0.038 | 0.711 |
| Total number of observations | 73950 | ||
| Number of reflections | 24858 | 280 | 1559 |
| <I/σ(I)> | 4.7 | ||
| Completeness [%] | 97.3 | 98.2 | 86.3 |
| Redundancy | 3 | 3 | 3 |
| CC(1/2) | 0.991 | 0.994 | 0.472 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293.15 | 0.1 M Tris-Cl pH 8.5, 20% PEG 2000 |
