1FG4
STRUCTURE OF TRYPAREDOXIN II
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] | 100 |
Detector technology | CCD |
Collection date | 2000-02-01 |
Detector | MARRESEARCH |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 109.280, 109.280, 55.497 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 77.000 - 1.900 |
R-factor | 0.195 * |
Rwork | 0.204 |
R-free | 0.24800 * |
RMSD bond length | 0.032 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | SOLVE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.800 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.103 * | 0.250 |
Number of reflections | 25175 | |
<I/σ(I)> | 4.7 | |
Completeness [%] | 94.4 | 97.8 |
Redundancy | 5.4 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.2 | 19 * | Sodium citrate, HEPES, pH 8.2, VAPOR DIFFUSION, SITTING DROP, temperature 292K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | sodium acetate | 1.6 (M) | |
2 | 1 | reservoir | HEPES | 0.1 (M) | pH8.2 |