3BUI
Golgi mannosidase II D204A catalytic nucleophile mutant complex with Tris
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F1 |
Synchrotron site | CHESS |
Beamline | F1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-07-05 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.912 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.259, 108.988, 137.569 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 1.250 |
R-factor | 0.125 |
Rwork | 0.121 |
R-free | 0.15900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hty |
RMSD bond length | 0.012 |
RMSD bond angle | 0.032 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.280 |
High resolution limit [Å] | 1.250 | 1.250 |
Rmerge | 0.079 | 0.316 |
Number of reflections | 263244 | |
<I/σ(I)> | 13.2 | 4.7 |
Completeness [%] | 93.1 | 56.3 |
Redundancy | 6.9 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | Tris, NaCl, PEG6000, MPD; Tris is found in the active site under normal crystallization conditions, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |