Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "509143336c740d4b75f64d87787d1538",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.443,
"b": 148.259,
"c": 63.899,
"alpha": 90.00,
"beta": 99.71,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.260,1.640],
"number_observations_unique": 218554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 88.200
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.640],
"number_observations": 53509,
"number_observations_unique": 16824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.489
},
{
"type": "R(meas)",
"value": 0.584
},
{
"type": "R(pim)",
"value": 0.315
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 87.700
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
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}
]
},
{
"resolution_limits": [74.260,5.180],
"number_observations": 13495,
"number_observations_unique": 4098,
"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": 26.400
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}