Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "55e4ea660de57ad3863ff26392f16d64",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 56.279,
"b": 56.440,
"c": 101.664,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.050,1.860],
"number_observations": 165193,
"number_observations_unique": 27569,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.166
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
},
"refln_shells": [
{
"resolution_limits": [1.910,1.860],
"number_observations": 12166,
"number_observations_unique": 2010,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.267
},
{
"type": "R(meas)",
"value": 2.486
},
{
"type": "R(pim)",
"value": 1.007
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
},
{
"resolution_limits": [29.050,8.320],
"number_observations": 2255,
"number_observations_unique": 369,
"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": 46.400
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}