Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "104b8e2d1e4695c42d0ac3aecf76fd8b",
"space_group_name": "P 1",
"unit_cell": {
"a": 107.338,
"b": 116.545,
"c": 117.900,
"alpha": 61.50,
"beta": 82.77,
"gamma": 64.23
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.12,3],
"number_observations_unique": 88754,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 12
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.05,3],
"number_observations_unique": 4306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.883
},
{
"type": "R(pim)",
"value": 0.883
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.539
}
]
}
]
}