Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f09c346479f27fae9f9cfe6c379c6ad7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.171,
"b": 98.526,
"c": 59.142,
"alpha": 90.00,
"beta": 108.03,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.310,1.700],
"number_observations": 231847,
"number_observations_unique": 65228,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
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}
]
},
"refln_shells": [
{
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"number_observations": 12673,
"number_observations_unique": 3491,
"quality_factors": [
{
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"value": 0.739
},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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},
{
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}
]
},
{
"resolution_limits": [46.310,9.000],
"number_observations": 1641,
"number_observations_unique": 448,
"quality_factors": [
{
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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},
{
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}
]
}
]
}