Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b658bd40fca3b8032ad53a0894b38937",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.749,
"b": 95.749,
"c": 45.883,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.840,1.380],
"number_observations": 527980,
"number_observations_unique": 42800,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 12.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.400,1.380],
"number_observations": 16675,
"number_observations_unique": 2106,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.204
},
{
"type": "R(meas)",
"value": 2.359
},
{
"type": "R(pim)",
"value": 0.832
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.900
},
{
"type": "CC(1/2)",
"value": 0.392
}
]
},
{
"resolution_limits": [33.840,7.560],
"number_observations": 3420,
"number_observations_unique": 284,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 73.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}