Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "52c4a14f1ba76df91559b12fe072932b",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.730,
"b": 88.730,
"c": 39.369,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.370,0.980],
"number_observations": 1077647,
"number_observations_unique": 174071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 15.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 27375,
"number_observations_unique": 7710,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.269
},
{
"type": "R(meas)",
"value": 1.486
},
{
"type": "R(pim)",
"value": 0.754
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
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}
]
},
{
"resolution_limits": [44.370,5.370],
"number_observations": 7974,
"number_observations_unique": 1160,
"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",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
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}
]
}
]
}