Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e1e9530d06d0f7545bbef1f8fe134b55",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 66.455,
"b": 119.677,
"c": 66.750,
"alpha": 90.00,
"beta": 94.17,
"gamma": 90.00
},
"wavelengths": [0.95000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.810,2.750],
"number_observations": 53548,
"number_observations_unique": 13023,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.900,2.750],
"number_observations": 8173,
"number_observations_unique": 1938,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.729
},
{
"type": "R(pim)",
"value": 0.402
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
},
{
"resolution_limits": [37.810,8.700],
"number_observations": 1564,
"number_observations_unique": 404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 57.400
},
{
"type": "Completeness",
"value": 90.500
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}