6C3D
O2-, PLP-dependent L-arginine hydroxylase RohP quinonoid II 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 | 79.010, 112.560, 102.130 |
| Unit cell angles | 90.00, 96.26, 90.00 |
Refinement procedure
| Resolution | 64.409 - 1.550 |
| R-factor | 0.1612 |
| Rwork | 0.160 |
| R-free | 0.18560 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5dj1 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.846 |
| 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] | 64.410 | 64.410 | 1.580 |
| High resolution limit [Å] | 1.550 | 8.490 | 1.550 |
| Rmerge | 0.075 | 0.042 | 0.623 |
| Rmeas | 0.087 | 0.049 | 0.732 |
| Rpim | 0.044 | 0.026 | 0.381 |
| Total number of observations | 485514 | 2890 | 22835 |
| Number of reflections | 127676 | 791 | 6266 |
| <I/σ(I)> | 9.3 | 20.6 | 2.1 |
| Completeness [%] | 99.6 | 97.7 | 98.7 |
| Redundancy | 3.8 | 3.7 | 3.6 |
| CC(1/2) | 0.997 | 0.996 | 0.702 |
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 |
