3HIJ
Crystal structure of dihydrodipicolinate synthase from Bacillus anthracis in complex with its substrate, pyruvate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2008-08-15 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9536439 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 84.484, 124.617, 130.979 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.270 - 2.150 |
R-factor | 0.15507 |
Rwork | 0.153 |
R-free | 0.20997 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.024 |
RMSD bond angle | 1.871 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.270 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Number of reflections | 75883 | |
Completeness [%] | 100.0 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | hanging drop vapor diffusion, crystal soak | 8 | 277 | 20% PEG 3350, 0.1 M bis-tris propane, 0.2 M NaF, pH 8.0, hanging drop vapor diffusion, crystal soak, temperature 277K |