5Y5K
Time-resolved SFX structure of cytochrome P450nor : 20 ms after photo-irradiation of caged NO in the absence of NADH (NO-bound state), light data
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SACLA BEAMLINE BL3 |
| Synchrotron site | SACLA |
| Beamline | BL3 |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2016-12-06 |
| Detector | MPCCD |
| Wavelength(s) | 1.24 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.600, 102.300, 73.700 |
| Unit cell angles | 90.00, 92.60, 90.00 |
Refinement procedure
| Resolution | 19.919 - 2.100 |
| R-factor | 0.1482 |
| Rwork | 0.146 |
| R-free | 0.19350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1cl6 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.882 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.120 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 47209 | |
| <I/σ(I)> | 11.3 | 1.4 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 914.2 | 631.8 |
| CC(1/2) | 0.997 | 0.507 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH MODE | 8.5 | 293 | 34-38% PEG 10000, 0.1 M BIS-TRIS PROPANE 0.15 M Ammonium acetate |
