Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b536fb707cf0d7c26d4299506b0a5822",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 53.755,
"b": 79.713,
"c": 62.900,
"alpha": 90.0,
"beta": 94.2,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.93,1.50],
"number_observations_unique": 41887,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.1
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 2032,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.509
},
{
"type": "R(meas)",
"value": 0.705
},
{
"type": "R(pim)",
"value": 0.487
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.94
}
]
}
]
}