4BJZ
Crystal structure of 3-hydroxybenzoate 6-hydroxylase uncovers lipid- assisted flavoprotein strategy for regioselective aromatic hydroxylation: Native data
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2010-03-25 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 106.790, 106.790, 142.716 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.510 |
R-factor | 0.16984 |
Rwork | 0.168 |
R-free | 0.20051 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4bjy |
RMSD bond length | 0.018 |
RMSD bond angle | 1.928 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0033) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.700 | 1.540 |
High resolution limit [Å] | 1.510 | 1.510 |
Rmerge | 0.080 | 0.680 |
Number of reflections | 63875 | |
<I/σ(I)> | 7.6 | 1.5 |
Completeness [%] | 99.2 | 99.4 |
Redundancy | 3.5 | 3.6 |
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) |