5D6T
Crystal Structure of Aspergillus clavatus Sph3 in complex with GalNAc
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-03 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.97859 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.740, 58.880, 96.790 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.387 - 1.930 |
| R-factor | 0.1719 |
| Rwork | 0.170 |
| R-free | 0.21700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5c5g |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.002 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.5.6) |
| Refinement software | PHENIX (dev_1760) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.390 | 1.990 |
| High resolution limit [Å] | 1.930 | 1.930 |
| Rmerge | 0.062 | 0.402 |
| Number of reflections | 19185 | |
| <I/σ(I)> | 21.36 | |
| Completeness [%] | 96.5 | 98.3 |
| Redundancy | 5 | 4.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 2.0 M ammonium sulfate, 0.1 M HEPES:NaOH pH 7.5 |
