Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "875c9ba6095113d4233c08d8e02c98ae",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 183.03,
"b": 58.90,
"c": 67.23,
"alpha": 90.00,
"beta": 94.91,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.000,1.820],
"number_observations": 100061,
"number_observations_unique": 46573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 72.800
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.920,1.820],
"number_observations": 13824,
"number_observations_unique": 6445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.454
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 69.700
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.756
}
]
},
{
"resolution_limits": [20.000,5.760],
"number_observations": 4719,
"number_observations_unique": 1928,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 34.000
},
{
"type": "Completeness",
"value": 91.600
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}