1KH2
Crystal Structure of Thermus thermophilus HB8 Argininosuccinate Synthetase in complex with ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44B2 |
Synchrotron site | SPring-8 |
Beamline | BL44B2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-09-22 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0 |
Spacegroup name | H 3 |
Unit cell lengths | 228.910, 228.910, 161.680 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.900 * - 2.300 |
R-factor | 0.2087 * |
Rwork | 0.209 |
R-free | 0.24100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.430 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.960 | 2.370 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.074 * | 0.270 * |
Total number of observations | 685640 * | |
Number of reflections | 143708 | |
Completeness [%] | 99.9 | 99.9 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | tris, ammonium sulfate, glycerol, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 30 (mg/ml) | |
2 | 1 | reservoir | ammonium sulfate | 2.4 (M) | |
3 | 1 | reservoir | glycerol | 30 (%(v/v)) | |
4 | 1 | reservoir | Tris-HCl | 100 (mM) | pH8.5 |
5 | 1 | reservoir | ATP | 10 (mM) | |
6 | 1 | reservoir | 10 (mM) |