Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b3e0e5e9ecc33b0fdf80e36025f8a58a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.886,
"b": 27.135,
"c": 55.912,
"alpha": 90.00,
"beta": 100.33,
"gamma": 90.00
},
"wavelengths": [0.97622],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.279,1.311],
"number_observations": 150357,
"number_observations_unique": 25326,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 23.700
},
{
"type": "Completeness",
"value": 87.300
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.368,1.311],
"number_observations": 4209,
"number_observations_unique": 1266,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.536
},
{
"type": "R(pim)",
"value": 0.285
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 38.900
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.887
}
]
},
{
"resolution_limits": [40.279,3.819],
"number_observations": 8013,
"number_observations_unique": 1266,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 67.400
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}