Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5f25b8761c1021f2fecab74706ea2dbe",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 74.176,
"b": 74.176,
"c": 174.695,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.670,1.850],
"number_observations": 292708,
"number_observations_unique": 48154,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.850],
"number_observations": 16414,
"number_observations_unique": 2784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.859
},
{
"type": "R(pim)",
"value": 0.382
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.665
}
]
},
{
"resolution_limits": [43.670,9.070],
"number_observations": 2378,
"number_observations_unique": 488,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 51.300
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}