Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e6659e8f821d762a4556c4fb3380f1e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.871,
"b": 57.203,
"c": 64.854,
"alpha": 90.00,
"beta": 94.71,
"gamma": 90.00
},
"wavelengths": [0.92202],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.25,1.19],
"number_observations": 452707,
"number_observations_unique": 85308,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 84.2
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.21,1.19],
"number_observations": 1558,
"number_observations_unique": 1185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.746
},
{
"type": "R(meas)",
"value": 1.046
},
{
"type": "R(pim)",
"value": 0.733
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 1.3
},
{
"type": "CC(1/2)",
"value": 0.424
}
]
}
]
}