3ZD9
Potassium bound structure of E. coli ExoIX in P21
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Detector | MARRESEARCH |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 53.472, 38.275, 59.750 |
Unit cell angles | 90.00, 107.95, 90.00 |
Refinement procedure
Resolution | 19.870 - 2.000 |
R-factor | 0.16337 |
Rwork | 0.159 |
R-free | 0.24589 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3zd8 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.421 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | 0.370 |
Number of reflections | 14512 | |
<I/σ(I)> | 11.4 | 4.5 |
Completeness [%] | 89.0 | 85.3 |
Redundancy | 2.9 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | 0.2 M SODIUM THIOCYANATE, 10MM ZNCL2 20% PEG 3350, 0.1 M MES AT PH 6.5 |