Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9d56933dbcb2f0ab510c0fe9df60c9f4",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 115.571,
"b": 115.571,
"c": 596.315,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.87,3.49],
"number_observations_unique": 31460,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "R(meas)",
"value": 0.140
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.68,3.49],
"number_observations_unique": 4335,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.561
},
{
"type": "R(meas)",
"value": 3.924
},
{
"type": "R(pim)",
"value": 1.173
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 10.5
},
{
"type": "CC(1/2)",
"value": 0.328
}
]
}
]
}