Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e1f9d2fc985cc2bb05bc818a8f60cde9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 103.56,
"b": 79.81,
"c": 68.57,
"alpha": 90.00,
"beta": 130.25,
"gamma": 90.00
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.73,1.36],
"number_observations_unique": 87963,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.04601
},
{
"type": "R(meas)",
"value": 0.06507
},
{
"type": "R(pim)",
"value": 0.04601
},
{
"type": "I/SigI",
"value": 11.55
},
{
"type": "Completeness",
"value": 96.46
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.409,1.36],
"number_observations_unique": 7041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5934
},
{
"type": "R(meas)",
"value": 0.8392
},
{
"type": "R(pim)",
"value": 0.5934
},
{
"type": "I/SigI",
"value": 1.20
},
{
"type": "Completeness",
"value": 77.74
},
{
"type": "Redundancy",
"value": 1.3
},
{
"type": "CC(1/2)",
"value": 0.513
}
]
}
]
}