1JHO
Three-dimensional Structure of CobT in Complex with the Reaction Products of 5-methylbenzimidazole and NaMN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 278 |
Detector technology | AREA DETECTOR |
Collection date | 2000-06-20 |
Detector | SIEMENS HI-STAR |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 71.950, 89.980, 47.620 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.000 |
R-factor | 0.172 * |
Rwork | 0.172 |
R-free | 0.25600 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1d0s |
RMSD bond length | 0.009 |
RMSD bond angle | 1.840 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | TNT |
Refinement software | TNT |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.060 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.047 | 0.118 |
Number of reflections | 20347 | |
<I/σ(I)> | 13.3 | 3.8 |
Completeness [%] | 88.9 | 67.8 |
Redundancy | 3.9 | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 * | 298 | Ammonium Phosphate, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 6 (mg/ml) | |
2 | 1 | drop | Tris-HCl | 20 (mM) | |
3 | 1 | drop | 100 (mM) | ||
4 | 1 | reservoir | ammonium phosphate | 1.4 (M) |