Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "73294aa9ee5c96aaae3b8982a60a2af8",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 100.173,
"b": 182.511,
"c": 123.920,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03280],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.20],
"number_observations_unique": 56818,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.233
},
{
"type": "R(meas)",
"value": 0.247
},
{
"type": "R(pim)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 6.75
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.20],
"number_observations_unique": 2390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.678
},
{
"type": "R(meas)",
"value": 0.798
},
{
"type": "R(pim)",
"value": 0.404
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 83.7
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.576
}
]
}
]
}