1B9B
TRIOSEPHOSPHATE ISOMERASE OF THERMOTOGA MARITIMA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ENRAF-NONIUS FR571 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 1996-11-15 |
Detector | MARRESEARCH |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 125.950, 125.950, 103.720 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.850 |
R-factor | 0.211 * |
Rwork | 0.211 |
R-free | 0.24900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | BACILLUS STEAROTHERMOPHILUS TIM (PDB ENTRY 1BIM) |
RMSD bond length | 0.006 |
RMSD bond angle | 1.300 |
Data reduction software | DENZO |
Data scaling software | CCP4 |
Phasing software | AMoRE |
Refinement software | CNS (0.4) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.900 |
High resolution limit [Å] | 2.850 | 2.850 |
Rmerge | 0.086 | 0.299 |
Total number of observations | 88489 * | |
Number of reflections | 22000 | |
<I/σ(I)> | 9 | 6.7 |
Completeness [%] | 97.8 | 90 |
Redundancy | 3.1 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 8 * | 20 * | pH 7.0 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 8.5 (mg/ml) | |
2 | 1 | drop | Tris-HCl | 70 (mM) | |
3 | 1 | drop | EDTA | 2 (mM) | |
4 | 1 | drop | cysteamine | 5 (mM) | |
5 | 1 | drop | 400 (mM) | ||
6 | 1 | reservoir | Tris-HCl | 100 (mM) | |
7 | 1 | reservoir | ammonium sulfate | 2.0 (M) |