Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "aa5e4f49d41f31a977d43809e6b806c5",
"space_group_name": "I 41 3 2",
"unit_cell": {
"a": 166.382,
"b": 166.382,
"c": 166.382,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.22,2.90],
"number_observations": 702562,
"number_observations_unique": 9043,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 56.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 77.7
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [3.08,2.90],
"number_observations": 115697,
"number_observations_unique": 1431,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.118
},
{
"type": "R(meas)",
"value": 2.131
},
{
"type": "R(pim)",
"value": 0.236
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "Redundancy",
"value": 80.9
},
{
"type": "CC(1/2)",
"value": 0.934
}
]
}
]
}