Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8125163da00c84bf9e08d3db4b2fcca2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.52,
"b": 67.86,
"c": 40.24,
"alpha": 90.00,
"beta": 93.63,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.44,1.22],
"number_observations_unique": 60878,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 26.3
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.25,1.22],
"number_observations_unique": 3257,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "R(meas)",
"value": 0.147
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 70.3
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
}
]
}