Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "194f74cc02876af1c0e7357697156b3b",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 104.931,
"b": 104.931,
"c": 322.566,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.150,2.500],
"number_observations": 327664,
"number_observations_unique": 71274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.560,2.500],
"number_observations": 17648,
"number_observations_unique": 4325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.703
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.739
}
]
},
{
"resolution_limits": [47.150,11.990],
"number_observations": 3023,
"number_observations_unique": 770,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 26.400
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}