Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "86b113137928ac1b63f1f10961c553a9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.41,
"b": 67.67,
"c": 40.08,
"alpha": 90.00,
"beta": 93.39,
"gamma": 90.00
},
"wavelengths": [0.96864],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.34,1.14],
"number_observations_unique": 72428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 16.4
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.14],
"number_observations_unique": 4004,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.214
},
{
"type": "R(meas)",
"value": 0.240
},
{
"type": "R(pim)",
"value": 0.107
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 71.9
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
}
]
}