8FZ8
Structure of cytochrome P450sky2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-02-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97946 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 35.980, 97.850, 52.500 |
Unit cell angles | 90.00, 95.12, 90.00 |
Refinement procedure
Resolution | 35.840 - 1.430 |
R-factor | 0.164 |
Rwork | 0.163 |
R-free | 0.18260 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.895 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.18) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.290 | 1.450 |
High resolution limit [Å] | 1.430 | 1.430 |
Rmerge | 0.054 | 0.418 |
Rmeas | 0.063 | 0.483 |
Rpim | 0.030 | 0.238 |
Total number of observations | 253881 | 12781 |
Number of reflections | 64363 | 3208 |
<I/σ(I)> | 11.9 | 2.6 |
Completeness [%] | 96.6 | |
Redundancy | 3.9 | 4 |
CC(1/2) | 0.998 | 0.871 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2 M ammonium acetate, 0.1 M Tris:HCl buffer pH 8.5, 25% w/v PEG 3350 |