Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5aa41b956835d07b8dcd0f8d5d637bcb",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.120,
"b": 99.610,
"c": 99.909,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.07500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.420,2.000],
"number_observations": 600550,
"number_observations_unique": 41390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 17.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 14.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 39852,
"number_observations_unique": 2907,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.006
},
{
"type": "R(pim)",
"value": 0.556
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.589
}
]
},
{
"resolution_limits": [38.420,8.930],
"number_observations": 6880,
"number_observations_unique": 541,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 58.700
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}