Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e09cdd27a48591532b1de2a2ae39f25b",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 92.224,
"b": 92.224,
"c": 328.033,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.89842],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.03,2.20],
"number_observations_unique": 73184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.319
},
{
"type": "R(meas)",
"value": 0.332
},
{
"type": "R(pim)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 24.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [47.03,10.78],
"number_observations_unique": 769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 19.9
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 22.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.25,2.20],
"number_observations_unique": 4453,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.225
},
{
"type": "R(meas)",
"value": 2.397
},
{
"type": "R(pim)",
"value": 0.871
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.505
}
]
}
]
}