8H2J
Structure of Acb2 complexed with 3',3'-cGAMP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-X |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-06-25 |
Detector | RIGAKU HyPix-6000HE |
Wavelength(s) | 1.5418 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 103.464, 103.464, 101.596 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 12.870 - 2.400 |
Rwork | 0.244 |
R-free | 0.28000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Alphafold2 model |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1-4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 12.870 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.083 | 0.416 |
Number of reflections | 24846 | 2485 |
<I/σ(I)> | 31.83 | |
Completeness [%] | 99.2 | 98.4 |
Redundancy | 22.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | PEG 3350, Sodium bromide |