Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cf63154e4f6cec306f765d688110e9e4",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 218.181,
"b": 218.181,
"c": 321.904,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [122.530,2.300],
"number_observations": 954588,
"number_observations_unique": 197338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.167
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 7.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [2.340,2.300],
"number_observations": 47492,
"number_observations_unique": 9667,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.167
},
{
"type": "R(pim)",
"value": 0.572
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.563
}
]
},
{
"resolution_limits": [122.530,12.600],
"number_observations": 5887,
"number_observations_unique": 1325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 19.700
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}