Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a91ce3b8131862b3ee9940851caaa98b",
"space_group_name": "P 1",
"unit_cell": {
"a": 57.790,
"b": 74.352,
"c": 76.530,
"alpha": 96.848,
"beta": 109.890,
"gamma": 112.494
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.940,2.100],
"number_observations": 115864,
"number_observations_unique": 54189,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 88.000
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.170,2.100],
"number_observations": 9760,
"number_observations_unique": 4598,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "R(meas)",
"value": 0.519
},
{
"type": "R(pim)",
"value": 0.351
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.832
}
]
},
{
"resolution_limits": [68.940,8.930],
"number_observations": 1661,
"number_observations_unique": 785,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
}
]
}