Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "607bbcaa59cd03a43ed46d86498e1c23",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 109.597,
"b": 75.494,
"c": 97.229,
"alpha": 90.000,
"beta": 120.248,
"gamma": 90.000
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.4,2.9],
"number_observations_unique": 15350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.265
},
{
"type": "R(meas)",
"value": 0.289
},
{
"type": "R(pim)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.952
}
]
},
"refln_shells": [
{
"resolution_limits": [3.12,2.9],
"number_observations_unique": 2466,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.976
},
{
"type": "R(meas)",
"value": 1.051
},
{
"type": "R(pim)",
"value": 0.389
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.869
}
]
}
]
}