Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9f50b3eaba5e8dc4ddc49410f3a94c25",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.196,
"b": 80.196,
"c": 139.066,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.810,1.550],
"number_observations": 756821,
"number_observations_unique": 39242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 29.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.550],
"number_observations": 53206,
"number_observations_unique": 2769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.747
},
{
"type": "R(meas)",
"value": 0.767
},
{
"type": "R(pim)",
"value": 0.173
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.912
}
]
},
{
"resolution_limits": [27.810,6.920],
"number_observations": 9328,
"number_observations_unique": 543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 86.600
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 17.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}