Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9c68a161431d447f50667c1f3f6b3e8",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 52.282,
"b": 81.735,
"c": 91.535,
"alpha": 90.0,
"beta": 95.5,
"gamma": 90.0
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.84,2.00],
"number_observations_unique": 25946,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 17.6
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"number_observations_unique": 2601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.416
},
{
"type": "R(pim)",
"value": 0.246
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.817
}
]
}
]
}