Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f24e4462ac46df35a0264f786877d9dc",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.844,
"b": 88.844,
"c": 39.570,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.420,1.000],
"number_observations": 1112153,
"number_observations_unique": 165818,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 54535,
"number_observations_unique": 8146,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.120
},
{
"type": "R(meas)",
"value": 2.301
},
{
"type": "R(pim)",
"value": 0.883
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.433
}
]
},
{
"resolution_limits": [44.420,5.480],
"number_observations": 7155,
"number_observations_unique": 1085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 35.600
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}