Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "870cc5b5be64ac01d74ff5a62ebadce7",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 111.326,
"b": 111.326,
"c": 205.749,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.96,2.90],
"number_observations_unique": 17398,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.249
},
{
"type": "R(meas)",
"value": 0.258
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 13
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 28.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.08,2.90],
"number_observations_unique": 2744,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.783
},
{
"type": "R(meas)",
"value": 3.913
},
{
"type": "R(pim)",
"value": 0.995
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 28.7
},
{
"type": "CC(1/2)",
"value": 0.611
}
]
},
{
"resolution_limits": [48.96,8.71],
"number_observations_unique": 766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 51.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 23
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}