6STX
Copper oxidase from Colletotrichum graminicola
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-09-21 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.91587 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 172.327, 172.327, 172.327 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 121.850 - 1.900 |
| R-factor | 0.1821 |
| Rwork | 0.180 |
| R-free | 0.21870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6ryv |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.639 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0253) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 121.850 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.143 | 2.646 |
| Rpim | 0.549 | |
| Number of reflections | 66778 | 4284 |
| <I/σ(I)> | 13.9 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 24.4 | 25.1 |
| CC(1/2) | 0.999 | 0.631 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 291 | PEG 2000 MME, ammonium sulphate, sodium acetate |
