3I0G
Crystal structure of GTB C80S/C196S + DA + UDP-Gal
Experimental procedure
Experimental method | Molecular Replacement |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-002 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-04-27 |
Detector | RIGAKU RAXIS IV++ |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 52.545, 149.277, 79.454 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.870 - 1.400 |
R-factor | 0.19624 |
Rwork | 0.195 |
R-free | 0.22955 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lz7 |
RMSD bond length | 0.030 |
RMSD bond angle | 2.572 |
Data scaling software | d*TREK (9.1SSI) |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 19.920 | 19.920 | 1.870 |
High resolution limit [Å] | 1.810 | 3.890 | 1.810 |
Rmerge | 0.074 | 0.038 | 0.317 |
Number of reflections | 27621 | ||
<I/σ(I)> | 31.9 | 4.1 | |
Completeness [%] | 95.6 | 91.7 | 93.9 |
Redundancy | 4.55 | 4.81 | 4.22 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 279.15 | 35mM sodium acetate pH 4.6, 45 mM ADA, 30mM sodium chloride, 3-4 mM magnesium chloride, 3-3.5% PEG 4000, vapor diffusion, hanging drop, temperature 279.15K |