Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "754e8a8886a7f7963bcc03a4f77a3975",
"space_group_name": "P 1",
"unit_cell": {
"a": 47.060,
"b": 48.970,
"c": 83.418,
"alpha": 74.52,
"beta": 86.40,
"gamma": 69.96
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.40,1.67],
"number_observations": 137613,
"number_observations_unique": 74773,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.67],
"number_observations": 19923,
"number_observations_unique": 10764,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "R(meas)",
"value": 0.273
},
{
"type": "R(pim)",
"value": 0.191
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.926
}
]
}
]
}