8DEN
Heme-Free Cytochrome Variant ApoCyt
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-11-05 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.954 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.590, 85.880, 47.570 |
Unit cell angles | 90.00, 92.49, 90.00 |
Refinement procedure
Resolution | 47.530 - 1.690 |
R-factor | 0.186 |
Rwork | 0.184 |
R-free | 0.21660 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 8del |
RMSD bond length | 0.007 |
RMSD bond angle | 0.868 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.530 | 1.720 |
High resolution limit [Å] | 1.690 | 1.690 |
Rmerge | 0.087 | 0.627 |
Rmeas | 0.095 | 0.689 |
Rpim | 0.037 | 0.279 |
Number of reflections | 37769 | 1569 |
<I/σ(I)> | 10.9 | 2.3 |
Completeness [%] | 95.0 | 76.7 |
Redundancy | 6.2 | 5.7 |
CC(1/2) | 0.998 | 0.731 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 22% PEG 2000, 200 mM MgCl2, 100 mM Tris pH 8.5 |