Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "528db2cbde594b89b7f8c4edadf72f16",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 99.602,
"b": 100.540,
"c": 168.587,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [168.59,1.50],
"number_observations_unique": 267144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 13008,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.954
},
{
"type": "R(meas)",
"value": 1.053
},
{
"type": "R(pim)",
"value": 0.439
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.714
}
]
}
]
}