Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2c40270bdd843f06046abee15a618f6b",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 107.082,
"b": 107.082,
"c": 205.946,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97921],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.610,1.450],
"number_observations": 2648646,
"number_observations_unique": 122141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 25.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 21.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"number_observations": 129181,
"number_observations_unique": 5867,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.249
},
{
"type": "R(meas)",
"value": 1.278
},
{
"type": "R(pim)",
"value": 0.268
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 22.000
},
{
"type": "CC(1/2)",
"value": 0.838
}
]
},
{
"resolution_limits": [29.610,7.940],
"number_observations": 13746,
"number_observations_unique": 834,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 69.300
},
{
"type": "Completeness",
"value": 92.700
},
{
"type": "Redundancy",
"value": 16.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}