2YV3
Crystal Structure of Aspartate Semialdehyde Dehydrogenase from Thermus thermophilus HB8
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B2 |
Synchrotron site | SPring-8 |
Beamline | BL26B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-10-22 |
Detector | RIGAKU JUPITER 210 |
Wavelength(s) | 0.9789, 0.9000, 0.9793 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 125.167, 125.167, 116.463 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 2.700 |
R-factor | 0.303 |
Rwork | 0.303 |
R-free | 0.36800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gz3 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.750 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.071 | 0.294 |
Number of reflections | 29493 | |
<I/σ(I)> | 9.2 | 3.1 |
Completeness [%] | 99.3 | 95.6 |
Redundancy | 5.2 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 0.1M Tris-HCl (pH 8.2), 0.2M MgCl2, 30% PEG 4000, 3% ethylene glycol, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |