8UM0
The structure of NanH in complex with Neu5,7,9Ac(2,6)-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 | 93.184, 64.691, 65.578 |
| Unit cell angles | 90.00, 102.75, 90.00 |
Refinement procedure
| Resolution | 23.800 - 2.460 |
| R-factor | 0.1924 |
| Rwork | 0.190 |
| R-free | 0.23830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.481 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.000 | 2.650 |
| High resolution limit [Å] | 2.460 | 2.460 |
| Number of reflections | 25987 | 1267 |
| <I/σ(I)> | 16.1 | |
| Completeness [%] | 99.3 | |
| Redundancy | 3.9 | |
| CC(1/2) | 0.993 | 0.815 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M HEPES:NaOH pH 7.5, 20% PEG 8000 |
