8CRP
Streptavidin WT Co-TAML artificial metalloenzyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-09-11 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.99988 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 192.499, 57.701, 57.701 |
Unit cell angles | 90.00, 107.44, 90.00 |
Refinement procedure
Resolution | 45.954 - 2.000 |
Rwork | 0.202 |
R-free | 0.21400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.741 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 45.954 | 45.910 | 2.050 |
High resolution limit [Å] | 2.000 | 8.940 | 2.000 |
Rmerge | 0.097 | 0.044 | 1.377 |
Rmeas | 0.115 | 0.051 | 1.624 |
Rpim | 0.060 | 0.026 | 0.852 |
Number of reflections | 40202 | 3344 | 20880 |
<I/σ(I)> | 10.3 | ||
Completeness [%] | 98.2 | ||
Redundancy | 6.9 | 6.7 | 7 |
CC(1/2) | 0.998 | 0.997 | 0.577 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 2 M ammonium sulfate, 0.1 M sodium acetate pH 4.0 for soaking pH adjustment to pH 6.0 |