Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ed0fd28959cd0c5ccc904031143d3d8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 56.629,
"b": 79.416,
"c": 57.892,
"alpha": 90.00,
"beta": 116.44,
"gamma": 90.00
},
"wavelengths": [0.91808],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.39,1.67],
"number_observations_unique": 53176,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "R(meas)",
"value": 0.188
},
{
"type": "R(pim)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.70,1.67],
"number_observations_unique": 2648,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.419
},
{
"type": "R(meas)",
"value": 1.656
},
{
"type": "R(pim)",
"value": 0.839
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.364
}
]
}
]
}