Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fdb600a769b6d1573deab56cd3f9230e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.512,
"b": 71.865,
"c": 87.740,
"alpha": 90.00,
"beta": 111.42,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.66,1.99],
"number_observations_unique": 61001,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.1,1.99],
"number_observations_unique": 4384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.474
},
{
"type": "R(pim)",
"value": 0.265
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.807
}
]
}
]
}