9DKU
NanH sialidase from C. perfringens in complex with Sialyl LacNAc
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-002 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-01-30 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 93.745, 64.558, 66.342 |
| Unit cell angles | 90.00, 103.01, 90.00 |
Refinement procedure
| Resolution | 29.740 - 2.180 |
| R-factor | 0.1765 |
| Rwork | 0.173 |
| R-free | 0.23984 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.796 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0415) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.740 | 2.230 |
| High resolution limit [Å] | 2.180 | 2.180 |
| Number of reflections | 21322 | 955 |
| <I/σ(I)> | 12.9 | |
| Completeness [%] | 96.9 | |
| Redundancy | 4.2 | |
| CC(1/2) | 0.991 | 0.813 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1 M HEPES, PH 7.5 2.0 M ammonium sulfate |
