Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4db8b9aadb250424accf6cddbc91b0f1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.329,
"b": 82.496,
"c": 51.821,
"alpha": 90.00,
"beta": 114.83,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.6,1.73],
"number_observations_unique": 38900,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.04
},
{
"type": "I/SigI",
"value": 23.5
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.75,1.73],
"number_observations_unique": 3899,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.69
},
{
"type": "Completeness",
"value": 88.3
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.9
}
]
}
]
}