Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c6b10b048f3f192fa6e79d5efb925eaf",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.787,
"b": 57.220,
"c": 64.797,
"alpha": 90.00,
"beta": 94.72,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.23,1.23],
"number_observations": 445685,
"number_observations_unique": 79238,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 86.3
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.25,1.23],
"number_observations": 3220,
"number_observations_unique": 1667,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.127
},
{
"type": "R(meas)",
"value": 1.494
},
{
"type": "R(pim)",
"value": 0.966
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.403
}
]
}
]
}