Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "21e76180fd7656f5830f1aadadac8a9c",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 107.195,
"b": 125.475,
"c": 238.581,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.502,1.713],
"number_observations_unique": 169907,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.742,1.713],
"number_observations_unique": 8369,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.418
},
{
"type": "R(pim)",
"value": 0.768
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.345
}
]
}
]
}