7ZB1
S580A with 18mer
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-06-28 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9762 |
Spacegroup name | P 1 |
Unit cell lengths | 70.010, 104.610, 110.650 |
Unit cell angles | 115.81, 98.87, 93.79 |
Refinement procedure
Resolution | 55.840 - 2.000 |
R-factor | 0.207 |
Rwork | 0.205 |
R-free | 0.23800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5n4c |
RMSD bond length | 0.007 |
RMSD bond angle | 1.431 |
Data reduction software | APEX |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.840 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | 1.234 |
Rmeas | 0.108 | 1.460 |
Number of reflections | 182773 | 8886 |
<I/σ(I)> | 15 | 1 |
Completeness [%] | 98.0 | 96.9 |
Redundancy | 3.3 | 3.5 |
CC(1/2) | 0.996 | 0.545 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M sodium acetate, 0.1 M Bis-Tris propane (pH 6.0-6.5) and 28% PEG 3350 |