Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "157ad50701e76912cefaae10cf5a0ee3",
"space_group_name": "P 1",
"unit_cell": {
"a": 51.806,
"b": 65.542,
"c": 83.700,
"alpha": 72.12,
"beta": 87.62,
"gamma": 68.36
},
"wavelengths": [1.00004],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.000,2.330],
"number_observations": 142274,
"number_observations_unique": 40550,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "R(meas)",
"value": 0.161
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.410,2.330],
"number_observations": 12840,
"number_observations_unique": 3700,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.908
},
{
"type": "R(meas)",
"value": 1.073
},
{
"type": "R(pim)",
"value": 0.565
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.550
}
]
},
{
"resolution_limits": [48.000,9.010],
"number_observations": 2502,
"number_observations_unique": 688,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 19.600
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}