1G8G
ATP SULFURYLASE FROM S. CEREVISIAE: THE BINARY PRODUCT COMPLEX WITH APS
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-07-22 |
Detector | MARRESEARCH |
Wavelength(s) | 1.542 |
Spacegroup name | H 3 2 |
Unit cell lengths | 185.922, 185.922, 223.674 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 24.850 - 2.600 |
R-factor | 0.176 |
Rwork | 0.176 |
R-free | 0.22700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | residues 1-330 from 1G8F |
RMSD bond length | 0.010 |
RMSD bond angle | 1.600 |
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] | 25.000 | 2.760 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.110 * | 0.413 * |
Number of reflections | 45307 | |
<I/σ(I)> | 6.4 | 1.8 |
Completeness [%] | 99.5 | 97.3 |
Redundancy | 6 | 5.6 |
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) |