Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b4ac69a49a4af9fc583871bf8182977c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 209.423,
"b": 113.435,
"c": 190.136,
"alpha": 90.00,
"beta": 90.61,
"gamma": 90.00
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [190.125,1.863],
"number_observations": 2234234,
"number_observations_unique": 317044,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 15.8
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.977,1.863],
"number_observations": 116530,
"number_observations_unique": 15853,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.186
},
{
"type": "R(pim)",
"value": 0.469
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.679
}
]
},
{
"resolution_limits": [190.125,5.362],
"number_observations": 107903,
"number_observations_unique": 15852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 52.1
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}