Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4599a79ef792d5f8f058b19e91c7425b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.210,
"b": 43.361,
"c": 64.526,
"alpha": 90.00,
"beta": 102.87,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.57,1.43],
"number_observations": 138684,
"number_observations_unique": 41857,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 83.4
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.43],
"number_observations": 2047,
"number_observations_unique": 760,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.921
},
{
"type": "R(meas)",
"value": 1.118
},
{
"type": "R(pim)",
"value": 0.623
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.492
}
]
}
]
}