Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4073fbfb21f293e3a995524ef8f17d68",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 121.530,
"b": 171.054,
"c": 122.206,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.764,2.31],
"number_observations_unique": 55929,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.11
},
{
"type": "R(meas)",
"value": 0.12
},
{
"type": "R(pim)",
"value": 0.04
},
{
"type": "I/SigI",
"value": 16.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
},
"refln_shells": [
{
"resolution_limits": [2.37,2.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.54
},
{
"type": "R(meas)",
"value": 0.56
},
{
"type": "R(pim)",
"value": 0.15
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 0.93
}
]
}
]
}