Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "d4e99b1b9d9252fa7b8e077a135ca3c0",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 48.574,
"b": 114.768,
"c": 164.710,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.31,2.05],
"number_observations": 175746,
"number_observations_unique": 29132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.05],
"number_observations": 13291,
"number_observations_unique": 2230,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.801
},
{
"type": "R(meas)",
"value": 6.343
},
{
"type": "R(pim)",
"value": 2.524
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.334
}
]
}
]
}