7ZHD
Crystal structure of CtaZ in complex with Closthioamide
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 | 2020-08-29 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 104.640, 40.850, 44.810 |
Unit cell angles | 90.00, 91.64, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.650 |
R-factor | 0.1755 |
Rwork | 0.174 |
R-free | 0.19900 |
Structure solution method | SAD |
RMSD bond length | 0.003 |
RMSD bond angle | 1.202 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | CRANK2 |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.750 |
High resolution limit [Å] | 1.650 | 1.650 |
Rmerge | 0.033 | 0.548 |
Number of reflections | 22520 | 3648 |
<I/σ(I)> | 15.9 | 2.2 |
Completeness [%] | 97.9 | 99.3 |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 100 mM Na-cacodylate, 200 mM ZnAc2, 18% PEG 8000 |