Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "113b8852860227e4d7285fd67dd18a05",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 43.114,
"b": 86.280,
"c": 64.088,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97650],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.6,1.60],
"number_observations_unique": 31452,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 20.7
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 7.6
},
{
"type": "CC(1/2)",
"value": 0.835
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 1493,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.23
},
{
"type": "R(meas)",
"value": 2.4
},
{
"type": "R(pim)",
"value": 0.855
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 96.1
},
{
"type": "CC(1/2)",
"value": 0.333
}
]
}
]
}