Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6bbe09e28ce2195a6993c8588c7ca25f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 216.197,
"b": 70.260,
"c": 142.379,
"alpha": 90.00,
"beta": 104.15,
"gamma": 90.00
},
"wavelengths": [0.95300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.110,2.200],
"number_observations": 387238,
"number_observations_unique": 105471,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.200],
"number_observations": 19150,
"number_observations_unique": 5151,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.663
},
{
"type": "R(pim)",
"value": 0.398
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.765
}
]
},
{
"resolution_limits": [75.110,12.050],
"number_observations": 2434,
"number_observations_unique": 702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}