Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d433765ba2ed71900577b91b970e957e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.234,
"b": 84.725,
"c": 87.992,
"alpha": 90.00,
"beta": 131.01,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.970,1.330],
"number_observations_unique": 122118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 14.400
},
{
"type": "Completeness",
"value": 76.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.350,1.330],
"number_observations_unique": 1076,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.356
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.340
}
]
},
{
"resolution_limits": [43.970,3.610],
"number_observations_unique": 8220,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 59.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}