Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fcdc0f23dcefbd4b0d63263fe35a40d1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.459,
"b": 70.714,
"c": 58.879,
"alpha": 90.000,
"beta": 113.997,
"gamma": 90.000
},
"wavelengths": [0.92012],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.10,2.41],
"number_observations_unique": 16100,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.5,2.41],
"number_observations_unique": 1678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.625
},
{
"type": "R(meas)",
"value": 0.693
},
{
"type": "R(pim)",
"value": 0.295
},
{
"type": "I/SigI",
"value": 2
},
{
"type": "Completeness",
"value": 99
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.947
}
]
}
]
}