Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ebe8b2edd39c61f7c26970e0c0d87e8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.57,
"b": 67.92,
"c": 40.24,
"alpha": 90.00,
"beta": 93.28,
"gamma": 90.00
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.15,1.11],
"number_observations_unique": 82932,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 20.2
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.14,1.11],
"number_observations_unique": 5498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
},
{
"type": "R(meas)",
"value": 0.212
},
{
"type": "R(pim)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 6.2
},
{
"type": "Completeness",
"value": 89.0
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
}
]
}