Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b31d6564609b2008036a048b4c8dfe7e",
"space_group_name": "P 1",
"unit_cell": {
"a": 56.08,
"b": 57.63,
"c": 79.93,
"alpha": 90.00,
"beta": 89.81,
"gamma": 63.84
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.390,2.120],
"number_observations": 99386,
"number_observations_unique": 49667,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 6.500
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.180,2.120],
"number_observations": 7463,
"number_observations_unique": 3636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.427
},
{
"type": "R(pim)",
"value": 0.392
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.768
}
]
},
{
"resolution_limits": [43.390,9.480],
"number_observations": 1155,
"number_observations_unique": 533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 14.400
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
}
]
}