Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3aadbdb60b71e40c21d7cd9aef2742cd",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.724,
"b": 88.724,
"c": 39.397,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.360,1.000],
"number_observations": 1048839,
"number_observations_unique": 164813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 35678,
"number_observations_unique": 7542,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.579
},
{
"type": "R(meas)",
"value": 2.893
},
{
"type": "R(pim)",
"value": 1.280
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 92.100
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.401
}
]
},
{
"resolution_limits": [44.360,5.480],
"number_observations": 7527,
"number_observations_unique": 1091,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 71.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}