Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e718a4401a6438874f0ae7514a880953",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.309,
"b": 95.309,
"c": 45.826,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.210,1.200],
"number_observations": 585684,
"number_observations_unique": 56056,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 14.900
},
{
"type": "Completeness",
"value": 87.400
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.220,1.200],
"number_observations": 2587,
"number_observations_unique": 1332,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.020
},
{
"type": "R(meas)",
"value": 1.323
},
{
"type": "R(pim)",
"value": 0.833
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 42.700
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
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}
]
},
{
"resolution_limits": [31.210,6.570],
"number_observations": 5312,
"number_observations_unique": 423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 59.600
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}