7RCC
First stage engineered variant of I-OnuI after initial reassembly
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 108 |
Detector technology | PIXEL |
Collection date | 2019-12-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.977408 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.841, 119.741, 165.101 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.010 - 2.450 |
R-factor | 0.224 |
Rwork | 0.222 |
R-free | 0.27220 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qqy |
RMSD bond length | 0.004 |
RMSD bond angle | 0.648 |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.8.3) |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.010 | 50.000 | 2.540 |
High resolution limit [Å] | 2.450 | 5.280 | 2.450 |
Rmerge | 0.087 | 0.041 | 0.531 |
Rmeas | 0.093 | 0.044 | 0.577 |
Rpim | 0.032 | 0.015 | 0.219 |
Number of reflections | 47055 | 5002 | 4576 |
<I/σ(I)> | 7.9 | ||
Completeness [%] | 99.9 | 100 | 99.2 |
Redundancy | 8.3 | 8.3 | 6.4 |
CC(1/2) | 0.999 | 0.856 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 100mM TRIS pH 7.5, 50mM ammonium sulfate, 30% pentaerythritol ethoxylate 15/4 EO/OH |