Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6da3dcd6bb9b7cf48cffdf8a04af1aef",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 56.265,
"b": 68.842,
"c": 57.630,
"alpha": 90.00,
"beta": 97.43,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.970,2.050],
"number_observations": 92745,
"number_observations_unique": 27467,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.050],
"number_observations_unique": 2120,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.601
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.830
}
]
},
{
"resolution_limits": [43.970,8.940],
"number_observations_unique": 355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
}
]
}