Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e30df69f2a522b05df2ccb21c624ca53",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.326,
"b": 84.704,
"c": 88.116,
"alpha": 90.00,
"beta": 130.99,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.580,1.430],
"number_observations_unique": 107371,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 11.300
},
{
"type": "Completeness",
"value": 82.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.450,1.430],
"number_observations_unique": 2038,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.857
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 31.500
},
{
"type": "CC(1/2)",
"value": 0.330
}
]
},
{
"resolution_limits": [66.580,3.880],
"number_observations_unique": 6624,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 45.900
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}