Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "48cefce479bdb4f830a7b486bb8a1fd7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.59,
"b": 68.10,
"c": 40.36,
"alpha": 90.00,
"beta": 93.32,
"gamma": 90.00
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.52,1.38],
"number_observations_unique": 43095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 20.0
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.38],
"number_observations_unique": 3135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.458
},
{
"type": "R(meas)",
"value": 0.494
},
{
"type": "R(pim)",
"value": 0.183
},
{
"type": "I/SigI",
"value": 4.1
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.926
}
]
}
]
}