Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "111fd3da5f49af2bffcc04723d6ef71d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.061,
"b": 38.544,
"c": 89.992,
"alpha": 90.00,
"beta": 104.62,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [87.08,1.91],
"number_observations_unique": 25285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 84.1
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.12,1.91],
"number_observations_unique": 963,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.971
},
{
"type": "R(meas)",
"value": 1.085
},
{
"type": "R(pim)",
"value": 0.470
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 34.2
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.571
}
]
}
]
}