9BEP
Structure of S1_8C, a lambda-carrageenan specific sulfatase, in complex with an oligosaccharide
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-09-09 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.541 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 98.236, 162.127, 231.033 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.884 - 1.898 |
| R-factor | 0.2056 |
| Rwork | 0.204 |
| R-free | 0.23270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.116 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.930 |
| High resolution limit [Å] | 1.898 | 1.898 |
| Rmerge | 0.064 | 0.474 |
| Rpim | 0.031 | 0.362 |
| Number of reflections | 144283 | 7116 |
| <I/σ(I)> | 21.6 | |
| Completeness [%] | 99.7 | |
| Redundancy | 4.2 | |
| CC(1/2) | 0.997 | 0.739 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 25% PEG 3350, 0.15 M sodium nitrate, 5% glycerol |
