Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b30f697cbbc453575401af53b9dff87c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 87.313,
"b": 131.511,
"c": 82.585,
"alpha": 90.00,
"beta": 103.81,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.20,1.10],
"number_observations": 2207969,
"number_observations_unique": 345136,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 12.4
},
{
"type": "Completeness",
"value": 94.7
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.13,1.10],
"number_observations": 59166,
"number_observations_unique": 15798,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.056
},
{
"type": "R(meas)",
"value": 1.229
},
{
"type": "R(pim)",
"value": 0.617
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.574
}
]
}
]
}