Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "a685d8e42def1c6236e2ebafec455035",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 168.222,
"b": 168.222,
"c": 52.030,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.00,1.70],
"number_observations_unique": 92697,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.205
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 20.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.73,1.70],
"number_observations_unique": 4598,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.859
},
{
"type": "R(meas)",
"value": 3.009
},
{
"type": "R(pim)",
"value": 0.935
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 20.4
},
{
"type": "CC(1/2)",
"value": 0.353
}
]
}
]
}