Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "56d7a31c0e8473fe876c50d498f7ec0f",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 76.359,
"b": 101.730,
"c": 125.540,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.04,2.25],
"number_observations_unique": 21740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 93.1
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.37,2.25],
"number_observations_unique": 3155,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.088
},
{
"type": "R(pim)",
"value": 0.549
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.549
}
]
}
]
}