Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "35b851474dbe059b79bbf99a553b4c32",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.933,
"b": 53.448,
"c": 44.373,
"alpha": 90.00,
"beta": 101.23,
"gamma": 90.00
},
"wavelengths": [0.91266],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.21,1.64],
"number_observations": 102289,
"number_observations_unique": 32135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "R(meas)",
"value": 0.171
},
{
"type": "R(pim)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 6.8
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.67,1.64],
"number_observations": 4376,
"number_observations_unique": 1570,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.225
},
{
"type": "R(meas)",
"value": 1.520
},
{
"type": "R(pim)",
"value": 0.888
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.261
}
]
}
]
}