Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "16a2ab53b5915d212aa8db87344e3ca5",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.762,
"b": 88.762,
"c": 39.549,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.380,0.960],
"number_observations": 1264309,
"number_observations_unique": 187265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [0.980,0.960],
"number_observations": 58130,
"number_observations_unique": 9048,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.359
},
{
"type": "R(meas)",
"value": 2.568
},
{
"type": "R(pim)",
"value": 1.002
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.460
}
]
},
{
"resolution_limits": [44.380,5.260],
"number_observations": 8259,
"number_observations_unique": 1230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 52.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
}
]
}