Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c2e53723662a0dd7c6891e1ceac195c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 64.258,
"b": 80.990,
"c": 149.579,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96863],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.44],
"number_observations_unique": 29505,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.48,2.44],
"number_observations_unique": 1438,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.554
},
{
"type": "R(meas)",
"value": 0.652
},
{
"type": "R(pim)",
"value": 0.334
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.687
}
]
}
]
}