Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "84c47b50a6166d8fbf6a4c503e699097",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 126.520,
"b": 126.520,
"c": 134.091,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96863],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [92.050,1.768],
"number_observations_unique": 106193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 11.0
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.820,1.770],
"number_observations_unique": 7721,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.354
},
{
"type": "R(pim)",
"value": 0.482
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.700
},
{
"type": "CC(1/2)",
"value": 0.761
}
]
},
{
"resolution_limits": [92.050,7.920],
"number_observations_unique": 1374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 33.7
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 23.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}