Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "211c8f22c55747427f5d9aa73c5e36ad",
"space_group_name": "P 1",
"unit_cell": {
"a": 35.752,
"b": 47.973,
"c": 48.153,
"alpha": 82.68,
"beta": 76.35,
"gamma": 85.81
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.530,1.700],
"number_observations": 117157,
"number_observations_unique": 33010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.700],
"number_observations": 5983,
"number_observations_unique": 1686,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.795
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.647
}
]
},
{
"resolution_limits": [47.530,9.000],
"number_observations": 813,
"number_observations_unique": 225,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
}
]
}