Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a1f2159252ffb4cee504087d3dbf1b9e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 163.249,
"b": 67.825,
"c": 173.693,
"alpha": 90.0,
"beta": 103.2,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.80],
"number_observations_unique": 45906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 15.63
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.90,2.80],
"number_observations_unique": 4577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.6917
},
{
"type": "I/SigI",
"value": 2.78
},
{
"type": "Completeness",
"value": 99.78
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.708
}
]
}
]
}