Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "56233ff965513475bb9ecd649b3416f4",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 120.082,
"b": 120.082,
"c": 237.380,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.640,2.490],
"number_observations": 367204,
"number_observations_unique": 30758,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.323
},
{
"type": "R(meas)",
"value": 0.339
},
{
"type": "R(pim)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.590,2.490],
"number_observations": 42120,
"number_observations_unique": 3391,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.274
},
{
"type": "R(meas)",
"value": 7.584
},
{
"type": "R(pim)",
"value": 2.130
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 12.400
},
{
"type": "CC(1/2)",
"value": 0.356
}
]
},
{
"resolution_limits": [48.640,8.980],
"number_observations": 8223,
"number_observations_unique": 752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.192
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
}
]
}