Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "04f788e00d1d05d0564bf5bbb8ea3fd3",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 67.958,
"b": 89.649,
"c": 44.990,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.16,1.148],
"number_observations_unique": 86185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 87.3
},
{
"type": "Redundancy",
"value": 11.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.168,1.148],
"number_observations_unique": 1992,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.159
},
{
"type": "R(meas)",
"value": 1.276
},
{
"type": "R(pim)",
"value": 0.52
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 41.2
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.525
}
]
}
]
}