Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5b980ae93ba99ff90b696c48f99166ab",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 81.759,
"b": 97.216,
"c": 58.147,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.070,1.650],
"number_observations": 178006,
"number_observations_unique": 27756,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 4720,
"number_observations_unique": 1025,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.735
},
{
"type": "R(pim)",
"value": 0.353
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 74.000
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.890
}
]
},
{
"resolution_limits": [29.070,9.030],
"number_observations": 1222,
"number_observations_unique": 203,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 47.600
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}