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 |
