1W1B
Structure of Bacillus subtilis PdaA with Cadmium, a family 4 Carbohydrate esterase.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICRO |
Temperature [K] | 100 |
Collection date | 2003-11-10 |
Detector | RIGAKU R-AXIS IV |
Spacegroup name | P 65 |
Unit cell lengths | 87.824, 87.824, 120.562 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.850 - 2.100 |
R-factor | 0.179 |
Rwork | 0.179 |
R-free | 0.22700 |
Structure solution method | MIRAS |
RMSD bond length | 0.010 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MLPHARE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.110 | 0.650 |
Number of reflections | 30220 | |
<I/σ(I)> | 8.5 | 2.6 |
Completeness [%] | 98.5 | 97.8 |
Redundancy | 6.2 | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | pH 7.50 |