Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9c65fea169c2a0f6ba737afe3b97d95",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 60.078,
"b": 60.078,
"c": 96.266,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95386],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [96.270,1.010],
"number_observations": 1783109,
"number_observations_unique": 103054,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 17.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 27449,
"number_observations_unique": 3978,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.093
},
{
"type": "R(meas)",
"value": 2.263
},
{
"type": "R(pim)",
"value": 0.825
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 76.500
},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
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}
]
},
{
"resolution_limits": [96.270,5.530],
"number_observations": 14438,
"number_observations_unique": 762,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 100.100
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
"value": 18.900
},
{
"type": "CC(1/2)",
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}
]
}
]
}