8VCS
Crystal structure of the oligomeric rMcL-1 in complex with lactose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 101 |
| Detector technology | PIXEL |
| Collection date | 2017-01-18 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.908, 77.871, 155.796 |
| Unit cell angles | 90.00, 90.05, 90.00 |
Refinement procedure
| Resolution | 49.390 - 1.890 |
| R-factor | 0.1687 |
| Rwork | 0.167 |
| R-free | 0.18830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.425 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.21rc1_5156) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.390 | 1.920 |
| High resolution limit [Å] | 1.890 | 1.890 |
| Rmerge | 0.048 | |
| Rmeas | 0.062 | |
| Rpim | 0.029 | |
| Number of reflections | 122227 | 5082 |
| <I/σ(I)> | 24.5 | 2.6 |
| Completeness [%] | 97.1 | 90.4 |
| Redundancy | 3.7 | 2.4 |
| CC(1/2) | 0.827 | 0.800 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291.15 | 18% PEG 4000, 50 mM sodium acetate, 0.1 M HEPES, 0.1 M lithium sulfate |
