Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "25d994371b2be0003dbc1b45a024b4a0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.989,
"b": 95.733,
"c": 68.579,
"alpha": 90.000,
"beta": 91.982,
"gamma": 90.000
},
"wavelengths": [1.00002],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.87,1.95],
"number_observations_unique": 47368,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07939
},
{
"type": "I/SigI",
"value": 11.80
},
{
"type": "Completeness",
"value": 98.72
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.95],
"number_observations_unique": 4760,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5428
},
{
"type": "I/SigI",
"value": 2.47
},
{
"type": "Completeness",
"value": 99.44
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.782
}
]
}
]
}