1G8F
ATP SULFURYLASE FROM S. CEREVISIAE
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 90 |
Detector technology | CCD |
Collection date | 2000-03-12 |
Detector | MARRESEARCH |
Wavelength(s) | 1.042 |
Spacegroup name | H 3 2 |
Unit cell lengths | 187.094, 187.094, 115.999 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.680 - 1.950 |
R-factor | 0.196 |
Rwork | 0.196 |
R-free | 0.23100 |
Structure solution method | MIR |
RMSD bond length | 0.010 |
RMSD bond angle | 1.500 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | CCP4 |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.070 |
High resolution limit [Å] | 1.950 | 1.950 |
Rmerge | 0.051 * | 0.280 * |
Number of reflections | 55315 | |
<I/σ(I)> | 9.3 | 2.7 |
Completeness [%] | 98.3 | 98.6 |
Redundancy | 3.8 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 18 * | 500 mM Sodium acetate, 50 mM HEPES, 25 mM Cadmium sulfate , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 20 (mg/ml) | |
2 | 1 | drop | Tris-HCl | 20 (mM) | |
3 | 1 | drop | EDTA | 1 (mM) | |
4 | 1 | drop | 1 (mM) | ||
5 | 1 | reservoir | 0.5 (M) | ||
6 | 1 | reservoir | HEPES | 50 (mM) | |
7 | 1 | reservoir | 25 (mM) |