Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 295 |
Detector technology | IMAGE PLATE |
Collection date | 1998-11-01 |
Detector | RIGAKU RAXIS IV |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 96.690, 96.690, 258.600 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 8.000 - 2.400 |
R-factor | 0.193 |
Rwork | 0.193 |
R-free | 0.25400 |
Structure solution method | AB INITIO |
RMSD bond length | 0.000 |
RMSD bond angle | 0.020 |
Data scaling software | SCALEPACK |
Phasing software | SHELX |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 8.000 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.107 | 0.740 |
Number of reflections | 53535 | |
<I/σ(I)> | 10.1 | |
Completeness [%] | 89.5 | 78 |
Redundancy | 1.99 | 1.64 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 296 | 2.2M NaCl 0.1M Sodium Citrate (pH4) 0.3M manoheptose, VAPOR DIFFUSION, HANGING DROP, temperature 296K |