Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f844d1f17a970bb5a0de6a3444d95c90",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.359,
"b": 41.402,
"c": 72.307,
"alpha": 90.000,
"beta": 103.972,
"gamma": 90.000
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,1.20],
"number_observations_unique": 73862,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 25.3
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 7.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 3600,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.448
},
{
"type": "R(meas)",
"value": 0.481
},
{
"type": "R(pim)",
"value": 0.175
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 94.3
},
{
"type": "Redundancy",
"value": 7.5
},
{
"type": "CC(1/2)",
"value": 0.906
}
]
}
]
}