6JE1
Ligand complex structure of GH10 family xylanase XynAF1, soaking for 40 minutes
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-22 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 |
| Unit cell lengths | 44.348, 57.400, 64.924 |
| Unit cell angles | 73.88, 80.47, 68.59 |
Refinement procedure
| Resolution | 62.210 - 1.180 |
| R-factor | 0.133 |
| Rwork | 0.132 |
| R-free | 0.15100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.523 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.210 | 1.220 |
| High resolution limit [Å] | 1.180 | 1.180 |
| Rmerge | 0.054 | 0.393 |
| Number of reflections | 171991 | |
| <I/σ(I)> | 24.5 | 3.5 |
| Completeness [%] | 91.5 | 89.43 |
| Redundancy | 3.6 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1M MES pH6.5, 25%(w/v) PEG 6000 |
