Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2bbc6b5cfbbce3915a757f80fb18cd85",
"space_group_name": "C 2 2 2",
"unit_cell": {
"a": 113.598,
"b": 174.678,
"c": 97.412,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.10,3.65],
"number_observations_unique": 20687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.203
},
{
"type": "R(meas)",
"value": 0.212
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 12.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [4.00,3.65],
"number_observations_unique": 2600,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.116
},
{
"type": "R(meas)",
"value": 3.242
},
{
"type": "R(pim)",
"value": 1.229
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.546
}
]
}
]
}