4BPT
Structural and thermodynamic insight into phenylalanine hydroxylase from the human pathogen Legionella pneumophila
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 90.320, 60.120, 124.040 |
Unit cell angles | 90.00, 94.07, 90.00 |
Refinement procedure
Resolution | 10.000 - 2.500 |
R-factor | 0.26481 |
Rwork | 0.264 |
R-free | 0.30203 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2v27 |
RMSD bond length | 0.018 |
RMSD bond angle | 2.083 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.080 | 0.390 |
Number of reflections | 41892 | |
<I/σ(I)> | 0 | 2.2 |
Completeness [%] | 90.4 | 94 |
Redundancy | 2.3 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 1.6 M NAK2PO4, 4% (V/V) PEG 400 |