Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "df00bf9fe1e9ebe83266391a62122fe3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 157.805,
"b": 37.581,
"c": 40.913,
"alpha": 90.00,
"beta": 98.59,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,1.94],
"number_observations_unique": 17530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.94],
"number_observations_unique": 1183,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.567
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.876
}
]
}
]
}