Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "59ecf368629bf09b671e10eb2032066e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.397,
"b": 98.967,
"c": 59.152,
"alpha": 90.00,
"beta": 108.34,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.830,1.600],
"number_observations": 260948,
"number_observations_unique": 77930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 7619,
"number_observations_unique": 3062,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.352
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 75.600
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.855
}
]
},
{
"resolution_limits": [48.830,8.620],
"number_observations": 1882,
"number_observations_unique": 537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 26.600
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}