Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0e84c8403a967db5b7438b583f431170",
"space_group_name": "P 1",
"unit_cell": {
"a": 101.476,
"b": 102.981,
"c": 103.044,
"alpha": 90.98,
"beta": 119.37,
"gamma": 117.18
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.900,3.000],
"number_observations_unique": 59382,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 6.300
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.080,3.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.811
},
{
"type": "R(meas)",
"value": 1.123
},
{
"type": "R(pim)",
"value": 0.775
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.379
}
]
},
{
"resolution_limits": [45.900,13.420],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}