Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "11cb02863179138ea783433914a390d4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 144.851,
"b": 85.914,
"c": 90.043,
"alpha": 90.00,
"beta": 104.77,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.520,1.810],
"number_observations": 416348,
"number_observations_unique": 91094,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.810],
"number_observations": 7278,
"number_observations_unique": 2206,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.595
},
{
"type": "R(pim)",
"value": 1.584
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 46.600
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.116
}
]
},
{
"resolution_limits": [38.520,9.920],
"number_observations": 2767,
"number_observations_unique": 606,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 75.400
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}