Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "642d7e30ad2cf21ac8e4b923df6ba15a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 73.953,
"b": 109.530,
"c": 116.750,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.58,2.2],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "R(meas)",
"value": 0.170
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.27,2.2],
"number_observations_unique": 48806,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.420
},
{
"type": "R(meas)",
"value": 1.532
},
{
"type": "R(pim)",
"value": 0.571
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.620
}
]
}
]
}