Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "951ce5bc87e9e433bff29476582ac2c8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.87,
"b": 83.59,
"c": 42.83,
"alpha": 90.00,
"beta": 95.19,
"gamma": 90.00
},
"wavelengths": [1.54187],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.66,2.0],
"number_observations_unique": 16996,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 17.8
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.071,2.0],
"number_observations_unique": 1622,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2312
},
{
"type": "R(pim)",
"value": 0.2228
},
{
"type": "I/SigI",
"value": 3.69
},
{
"type": "Completeness",
"value": 92.26
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.895
}
]
}
]
}