1IUV
P-HYDROXYBENZOATE HYDROXYLASE COMPLEXED WITH 4-4-HYDROXYBENZOATE AT PH 5.0
Experimental procedure
Temperature [K] | 295 |
Detector technology | AREA DETECTOR |
Detector | SDMS |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 71.650, 146.430, 88.770 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 2.500 |
R-factor | 0.173 |
Rwork | 0.173 |
RMSD bond length | 0.011 |
RMSD bond angle | 23.980 * |
Data reduction software | SDMS |
Phasing software | X-PLOR |
Refinement software | X-PLOR |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.000 | 2.650 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.097 | 0.310 |
Number of reflections | 16343 | |
<I/σ(I)> | 9 | 2.21 |
Completeness [%] | 99.3 | 97.61 |
Redundancy | 6.32 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | interface diffusion * | 7.4 * | 4-23 * | pH 5.0 |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | PHBH | 10 (mg/ml) | 0.005ml |
2 | 1 | 1 | potassium phosphate | 0.1 (M) | |
3 | 1 | 1 | p-OHB | 2 (mM) | |
4 | 1 | 1 | FAD | 0.004 (mM) | |
5 | 1 | 1 | glutathione | 0.2 (mM) | |
6 | 1 | 2 | ammonium sulfate | 71 (%sat) | |
7 | 1 | 2 | potassium phosphate | 0.1 (M) |