Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "456b316ae1671d6bf373297b7accc30a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.333,
"b": 86.290,
"c": 118.585,
"alpha": 90.00,
"beta": 95.36,
"gamma": 90.00
},
"wavelengths": [0.96800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.67,3.17],
"number_observations_unique": 24764,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [3.39,3.17],
"number_observations_unique": 4500,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.391
},
{
"type": "R(pim)",
"value": 0.265
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.914
}
]
}
]
}