Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a698c3071074236247ce635465584a5b",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 102.946,
"b": 137.889,
"c": 178.607,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [109.15,2.07],
"number_observations_unique": 36863,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 12.9
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [109.15,7.41],
"number_observations_unique": 1843,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 42.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.365,2.07],
"number_observations_unique": 1843,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.343
},
{
"type": "R(pim)",
"value": 0.420
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 81.5
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.758
}
]
}
]
}