Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4d3853ae9ab275aac8e428bee104c81b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.083,
"b": 41.418,
"c": 72.210,
"alpha": 90.00,
"beta": 104.32,
"gamma": 90.00
},
"wavelengths": [0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,1.35],
"number_observations_unique": 53079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.159
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 18.0
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.955
}
]
},
"refln_shells": [
{
"resolution_limits": [1.39,1.35],
"number_observations_unique": 3770,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.349
},
{
"type": "R(meas)",
"value": 0.410
},
{
"type": "R(pim)",
"value": 0.213
},
{
"type": "I/SigI",
"value": 3.5
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.850
}
]
}
]
}