Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2431eca9e2428405155d1f0d84d5ccdb",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 77.609,
"b": 103.000,
"c": 128.410,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.35,2.35],
"number_observations_unique": 20611,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 95.3
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.46,2.35],
"number_observations_unique": 3070,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.695
},
{
"type": "R(pim)",
"value": 1.362
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "CC(1/2)",
"value": 0.480
}
]
}
]
}