6C3A
O2-, PLP-dependent L-arginine hydroxylase RohP 4-hydroxy-2-ketoarginine complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-01-28 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 78.800, 112.550, 101.970 |
Unit cell angles | 90.00, 96.39, 90.00 |
Refinement procedure
Resolution | 41.687 - 1.530 |
R-factor | 0.1538 |
Rwork | 0.153 |
R-free | 0.17280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dj1 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.921 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless (0.5.23) |
Phasing software | PHASER |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 52.170 | 52.170 | 1.560 |
High resolution limit [Å] | 1.530 | 8.380 | 1.530 |
Rmerge | 0.076 | 0.045 | 0.652 |
Rmeas | 0.087 | 0.053 | 0.747 |
Rpim | 0.042 | 0.027 | 0.362 |
Total number of observations | 560442 | 3373 | 26955 |
Number of reflections | 132732 | 836 | 6503 |
<I/σ(I)> | 9.6 | 21.8 | 2.1 |
Completeness [%] | 100.0 | 98.8 | 100 |
Redundancy | 4.2 | 4 | 4.1 |
CC(1/2) | 0.997 | 0.995 | 0.700 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 0.2 M sodium malonate pH 7, 16-20 % (w/v) PEG 3350 |