Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ba1f1755d192ff3f8050cd31ef1b11d4",
"space_group_name": "P 1",
"unit_cell": {
"a": 41.675,
"b": 63.922,
"c": 74.994,
"alpha": 102.08,
"beta": 90.36,
"gamma": 90.14
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.3300,2.500],
"number_observations_unique": 21425,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 3.500
},
{
"type": "Completeness",
"value": 81.800
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.600,2.500],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.673
},
{
"type": "Completeness",
"value": 79.300
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.401
}
]
},
{
"resolution_limits": [43.310,9.010],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 77.400
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}