Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "94424b0bb113cba24c73df59f6cfa5fd",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 61.882,
"b": 86.627,
"c": 88.680,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [21.90,2.20],
"number_observations_unique": 12438,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.190
},
{
"type": "R(meas)",
"value": 0.210
},
{
"type": "R(pim)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 35.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.967
}
]
},
"refln_shells": [
{
"resolution_limits": [2.27,2.20],
"number_observations_unique": 1064,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.501
},
{
"type": "R(meas)",
"value": 0.585
},
{
"type": "R(pim)",
"value": 0.298
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.737
}
]
}
]
}