Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f1d9be4d262c634f2dae9cabbc47182f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 35.838,
"b": 67.410,
"c": 38.455,
"alpha": 90.000,
"beta": 101.371,
"gamma": 90.000
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.70,1.46],
"number_observations_unique": 31004,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.131
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.486,1.46],
"number_observations_unique": 1557,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.046
},
{
"type": "R(meas)",
"value": 1.167
},
{
"type": "R(pim)",
"value": 0.507
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.574
}
]
}
]
}