1MT0
ATP-binding domain of hemolysin B from Escherichia coli
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-09-22 |
Detector | MARRESEARCH |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 105.200, 105.200, 125.400 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.990 - 2.600 |
R-factor | 0.234 |
Rwork | 0.234 |
R-free | 0.26000 |
Structure solution method | MAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.760 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.076 * | 0.349 * |
<I/σ(I)> | 19.8 | 1.9 |
Completeness [%] | 97.3 | 99.3 |
Redundancy | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 7 * | 277 | PEG 8000, ammonium sulfate, (2-acetamido)iminodiacetic acid, sodium phosphate, potassium chloride, pH 6.25, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
1 | Vapor diffusion, hanging drop * | 7 * | 277 | PEG 8000, ammonium sulfate, (2-acetamido)iminodiacetic acid, sodium phosphate, potassium chloride, pH 6.25, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 10 (mg/ml) | |
2 | 1 | drop | sodium phosphate | 10 (mM) | pH8.0 |
3 | 1 | drop | 100 (mM) | ||
4 | 1 | drop | ATP | 50 (mM) | pH7.0 |
5 | 1 | reservoir | diamino acetic acid | 150 (mM) | pH6.2 |
6 | 1 | reservoir | PEG8000 | 16 (%(w/v)) | |
7 | 1 | reservoir | ammonium sulfate | 300 (mM) |