Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "fa223acbd53715011ffa152d50656d28",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.65,
"b": 148.30,
"c": 64.67,
"alpha": 90.00,
"beta": 100.12,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.15,2.02],
"number_observations": 205806,
"number_observations_unique": 68943,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "R(meas)",
"value": 0.220
},
{
"type": "R(pim)",
"value": 0.123
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.02],
"number_observations": 11657,
"number_observations_unique": 5012,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.672
},
{
"type": "R(meas)",
"value": 0.865
},
{
"type": "R(pim)",
"value": 0.537
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.366
}
]
}
]
}