Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a77d04eeb501139fbe7e3e2f735a1e0e",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 118.598,
"b": 180.153,
"c": 232.678,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.87,2.84],
"number_observations": 279000,
"number_observations_unique": 57339,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.188
},
{
"type": "R(pim)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.92,2.84],
"number_observations": 13875,
"number_observations_unique": 3421,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.855
},
{
"type": "R(meas)",
"value": 4.429
},
{
"type": "R(pim)",
"value": 2.114
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.081
}
]
}
]
}