4BJY
Crystal structure of 3-hydroxybenzoate 6-hydroxylase uncovers lipid- assisted flavoprotein strategy for regioselective aromatic hydroxylation: Platinum derivative
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-11-20 |
Detector | ADSC CCD |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 106.610, 106.610, 142.310 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.520 |
R-factor | 0.17507 |
Rwork | 0.173 |
R-free | 0.20499 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.021 |
RMSD bond angle | 2.104 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | SHELX |
Refinement software | REFMAC (5.8.0033) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.300 | 1.550 |
High resolution limit [Å] | 1.520 | 1.520 |
Rmerge | 0.060 | 0.580 |
Number of reflections | 62993 | |
<I/σ(I)> | 33.5 | 6.6 |
Completeness [%] | 100.0 | 100 |
Redundancy | 23.7 | 24.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 28% PEG 4000, 0.2 M SODIUM ACETATE AND 0.1 M TRIS-HCL (PH 8.5) |