Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a23475482bb32bc0f3dbf948fa64837c",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 68.169,
"b": 45.560,
"c": 176.270,
"alpha": 90.00,
"beta": 94.21,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.95,2.2],
"number_observations_unique": 54115,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.26,2.2],
"number_observations_unique": 4437,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.548
},
{
"type": "R(pim)",
"value": 0.542
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.693
}
]
}
]
}