Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a668761e601c59b75b6a9d7e2e6ebdbe",
"space_group_name": "I 4",
"unit_cell": {
"a": 161.321,
"b": 161.321,
"c": 154.004,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97242],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.33,1.80],
"number_observations_unique": 179725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0228
},
{
"type": "R(meas)",
"value": 0.0246
},
{
"type": "R(pim)",
"value": 0.0080
},
{
"type": "I/SigI",
"value": 11.58
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.87
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.80],
"number_observations_unique": 29116,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.985
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 1.40
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.97
},
{
"type": "CC(1/2)",
"value": 0.564
}
]
}
]
}