Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5ee0d78fe7a553af9d0de3998b6a8761",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.691,
"b": 42.206,
"c": 159.159,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91808],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.80,1.61],
"number_observations": 154341,
"number_observations_unique": 37156,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.61],
"number_observations": 18062,
"number_observations_unique": 5296,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.070
},
{
"type": "R(meas)",
"value": 1.255
},
{
"type": "R(pim)",
"value": 0.639
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.467
}
]
}
]
}