Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "56135857812d1dfe3785a00ff958a693",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 82.85,
"b": 96.56,
"c": 57.88,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92001],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.510,1.860],
"number_observations": 128725,
"number_observations_unique": 37326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 16.400
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.910,1.860],
"number_observations": 10097,
"number_observations_unique": 2811,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.595
},
{
"type": "R(pim)",
"value": 0.367
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.786
}
]
},
{
"resolution_limits": [42.510,8.320],
"number_observations": 1550,
"number_observations_unique": 426,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 52.300
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}