Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fa43fc80b9f94a155b957fe4d8c57661",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 36.817,
"b": 36.817,
"c": 141.205,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96550,2.75000,4.50000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.63,1.417],
"number_observations_unique": 19328,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [1.442,1.417],
"number_observations_unique": 926,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.276
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 49.1
},
{
"type": "CC(1/2)",
"value": 0.816
}
]
},
{
"resolution_limits": [2.95,2.90],
"number_observations_unique": 57,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.234
},
{
"type": "I/SigI",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.92
}
]
},
{
"resolution_limits": [1.80,1.77],
"number_observations_unique": 237,
"quality_factors": [
{
"type": "CC(1/2)",
"value": 0.759
}
]
}
]
}