6TC4
AA13 Lytic polysaccharide monooxygenase from Aspergillus oryzae measured with SSX
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-11-15 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.720, 61.430, 73.780 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.210 - 2.000 |
| R-factor | 0.1866 |
| Rwork | 0.185 |
| R-free | 0.22260 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4opb |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.334 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmeas | 0.424 | 2.386 |
| Number of reflections | 14527 | 1066 |
| <I/σ(I)> | 4.91 | 1.87 |
| Completeness [%] | 97.5 | 97.3 |
| Redundancy | 4.08 | 4.1 |
| CC(1/2) | 0.922 | 0.424 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 0.1 M Buffer system (II) (0.2M L-malic acid, 0.4 M MES, 0.4 M Tris) pH 5.0, 0.2 M Zn-acetate, 23% PEG 3000. |
