Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "78bdd1f26ca8dbf2a4e2db2f2c5b2a8c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 86.40,
"b": 57.25,
"c": 110.95,
"alpha": 90.00,
"beta": 94.75,
"gamma": 90.00
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.28,1.9],
"number_observations_unique": 85579,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.0,1.9],
"number_observations_unique": 12111,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.629
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.790
}
]
}
]
}