Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "05db50b1d11e5fd999e7fdcc5cf4c28a",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 58.595,
"b": 58.595,
"c": 397.601,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.390,1.600],
"number_observations": 2675664,
"number_observations_unique": 55524,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 24.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 48.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 131722,
"number_observations_unique": 2717,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.983
},
{
"type": "R(pim)",
"value": 0.572
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 48.500
},
{
"type": "CC(1/2)",
"value": 0.906
}
]
},
{
"resolution_limits": [47.390,8.760],
"number_observations": 16113,
"number_observations_unique": 485,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 80.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 33.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}