Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e28119375a5739a4f94ba2345cd9ce98",
"space_group_name": "P 1",
"unit_cell": {
"a": 52.17,
"b": 55.11,
"c": 64.26,
"alpha": 99.87,
"beta": 94.90,
"gamma": 103.24
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.595,2.03],
"number_observations_unique": 43063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1713
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 97.92
},
{
"type": "Redundancy",
"value": 3.57
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.03],
"number_observations_unique": 2096,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.553
},
{
"type": "R(pim)",
"value": 0.950
},
{
"type": "I/SigI",
"value": 0.75
},
{
"type": "Completeness",
"value": 96.46
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.304
}
]
}
]
}