Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "391acafa664912d9c22c428e8a1e1984",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 59.957,
"b": 59.957,
"c": 110.153,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.070,1.830],
"number_observations": 230062,
"number_observations_unique": 18491,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.880,1.830],
"number_observations": 17134,
"number_observations_unique": 1340,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.121
},
{
"type": "R(meas)",
"value": 2.208
},
{
"type": "R(pim)",
"value": 0.610
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.772
}
]
},
{
"resolution_limits": [55.070,8.180],
"number_observations": 2795,
"number_observations_unique": 273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 33.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}