Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0254b3163a59e40768b7f3cf35c58ddd",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 74.125,
"b": 134.031,
"c": 147.881,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.89842],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [147.88,2.38],
"number_observations_unique": 56875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.154
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 11
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [147.88,10.1],
"number_observations_unique": 913,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 44.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
{
"resolution_limits": [2.45,2.38],
"number_observations_unique": 4846,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.048
},
{
"type": "R(meas)",
"value": 2.214
},
{
"type": "R(pim)",
"value": 0.838
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "CC(1/2)",
"value": 0.593
}
]
}
]
}