6CC7
Structure of Fungal GH62 from Thielavia terretris
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE W01B-MX2 |
| Synchrotron site | LNLS |
| Beamline | W01B-MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-10-03 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.45863 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 75.267, 79.747, 82.922 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 57.480 - 1.870 |
| R-factor | 0.15019 |
| Rwork | 0.147 |
| R-free | 0.19533 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4o8n |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.628 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.480 | 1.910 |
| High resolution limit [Å] | 1.870 | 1.870 |
| Rmerge | 0.071 | 0.386 |
| Rmeas | 0.086 | 0.522 |
| Rpim | 0.045 | 0.349 |
| Number of reflections | 20946 | 1318 |
| <I/σ(I)> | 11.9 | 2.2 |
| Completeness [%] | 99.8 | 97.4 |
| Redundancy | 5.5 | 2.8 |
| CC(1/2) | 0.998 | 0.838 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 291 | 0.1 M sodium acetate, 2 M ammonium sulfate |
