Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c325117e3fb8ca429d2cafd89834fa6b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 72.928,
"b": 96.867,
"c": 124.981,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97947],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [58.260,2.070],
"number_observations": 320855,
"number_observations_unique": 53860,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.130,2.070],
"number_observations": 19432,
"number_observations_unique": 3984,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.649
},
{
"type": "R(pim)",
"value": 0.318
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.833
}
]
},
{
"resolution_limits": [58.260,9.020],
"number_observations": 3769,
"number_observations_unique": 645,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 76.900
},
{
"type": "Completeness",
"value": 90.900
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}