Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "091106487c7eb748bc1650b50ef437d3",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 125.669,
"b": 203.154,
"c": 207.792,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.340,1.950],
"number_observations": 2639550,
"number_observations_unique": 384285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.950],
"number_observations": 121492,
"number_observations_unique": 18863,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.958
},
{
"type": "R(pim)",
"value": 0.409
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
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}
]
},
{
"resolution_limits": [49.340,10.680],
"number_observations": 16558,
"number_observations_unique": 2565,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
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}
]
}
]
}