Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "db95d3244c8d5b8f46976139327332bf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 90.06,
"b": 128.56,
"c": 132.41,
"alpha": 90.00,
"beta": 101.46,
"gamma": 90.00
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.090,2.950],
"number_observations": 110137,
"number_observations_unique": 52130,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 9.100
},
{
"type": "Completeness",
"value": 84.800
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [3.040,2.950],
"number_observations": 9652,
"number_observations_unique": 4646,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.884
},
{
"type": "R(pim)",
"value": 0.684
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 87.500
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.471
}
]
},
{
"resolution_limits": [43.090,12.160],
"number_observations": 1628,
"number_observations_unique": 685,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 30.000
},
{
"type": "Completeness",
"value": 77.500
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.963
}
]
}
]
}