Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fb4f37a6010a418275da1d9ca09c294f",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 86.57,
"b": 86.57,
"c": 147.23,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.620,2.420],
"number_observations": 485941,
"number_observations_unique": 22043,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 18.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.510,2.420],
"number_observations": 41783,
"number_observations_unique": 2252,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.245
},
{
"type": "R(pim)",
"value": 0.294
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.600
},
{
"type": "CC(1/2)",
"value": 0.778
}
]
},
{
"resolution_limits": [73.620,9.070],
"number_observations": 9744,
"number_observations_unique": 515,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 49.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 18.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}