3BO4
A relaxed active site following exon ligation by a group I intron
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X26C |
Synchrotron site | NSLS |
Beamline | X26C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-07-27 |
Detector | ADSC |
Spacegroup name | P 41 2 2 |
Unit cell lengths | 111.188, 111.188, 240.300 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.710 - 3.330 |
R-factor | 0.281 |
Rwork | 0.280 |
R-free | 0.29600 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.167 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.420 |
High resolution limit [Å] | 3.300 | 3.300 |
Number of reflections | 22836 | |
Completeness [%] | 99.7 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.8 | 298 | MPD, Sodium Cacodylate, Magnesium Acetate, Potassium Acetate, Cobalt Hexamine, Potassium Vanadate, pH 6.80, vapor diffusion, hanging drop, temperature 298K |
Crystallization Reagents
ID | crystal ID | solution ID | reagent name | concentration | details |
1 | 1 | 1 | MPD | ||
10 | 1 | 1 | Potassium Vanadate | ||
2 | 1 | 2 | MPD | ||
3 | 1 | 1 | Sodium Cacodylate | ||
4 | 1 | 2 | Sodium Cacodylate | ||
5 | 1 | 1 | Magnesium Acetate | ||
6 | 1 | 2 | Magnesium Acetate | ||
7 | 1 | 1 | Potassium Acetate | ||
8 | 1 | 2 | Potassium Acetate | ||
9 | 1 | 1 | Cobalt Hexamine |