Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "53cb4c4b893929f8eca6f678a4bbc9d7",
"space_group_name": "P 65",
"unit_cell": {
"a": 80.97,
"b": 80.97,
"c": 54.62,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97740],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.090,2.260],
"number_observations": 47689,
"number_observations_unique": 9658,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 25.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.440,2.260],
"number_observations": 9818,
"number_observations_unique": 1972,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.558
},
{
"type": "R(pim)",
"value": 0.279
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.850
}
]
},
{
"resolution_limits": [43.090,5.980],
"number_observations": 2608,
"number_observations_unique": 547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 72.900
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}