3DDG
GOLGI MANNOSIDASE II complex with (3R,4R,5R)-3,4-Dihydroxy-5-({[(1R)-2-hydroxy-1 phenylethyl]amino}methyl) methylpyrrolidin-2-one
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-10-10 |
| Detector | BRUKER PROTEUM |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 69.189, 110.083, 138.960 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.020 - 1.740 |
| R-factor | 0.166 |
| Rwork | 0.166 |
| R-free | 0.19500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2f18 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.628 |
| Data reduction software | SAINT |
| Data scaling software | SAINT |
| Phasing software | CNS |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 1.790 |
| High resolution limit [Å] | 1.740 | 1.740 |
| Rmerge | 0.041 | 0.401 |
| Number of reflections | 108067 | |
| <I/σ(I)> | 26.3 | 2.74 |
| Completeness [%] | 98.7 | 81 |
| Redundancy | 21 | 2.92 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | PEG 8000, Tris, pH 7, 2.5% MPD, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
