6RSI
cytochrome c co-crystallized with 25 eq. sulfonato-calix[8]arene - structure 0
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 2 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-09-21 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.98009 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 101.320, 101.320, 86.100 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 71.640 - 2.480 |
R-factor | 0.195 |
Rwork | 0.194 |
R-free | 0.19900 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.240 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 71.640 | 2.525 |
High resolution limit [Å] | 2.480 | 2.482 |
Rmerge | 0.173 | 1.666 |
Rmeas | 0.176 | 1.700 |
Rpim | 0.035 | 0.334 |
Number of reflections | 16406 | 818 |
<I/σ(I)> | 14.9 | 2.3 |
Completeness [%] | 100.0 | |
Redundancy | 26.1 | |
CC(1/2) | 0.998 | 0.821 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.10 M HEPES pH 7.5, 0.15 M NaCl, 2.20 M ammonium sulfate, 0.05 M sulfonato-calix[8]arene. |