Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5da2f5cd96b9ed8c44183eb246f168ae",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 78.938,
"b": 51.327,
"c": 116.400,
"alpha": 90.000,
"beta": 108.735,
"gamma": 90.000
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.32,2.02],
"number_observations_unique": 31574,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 11.1
},
{
"type": "Completeness",
"value": 54.3
},
{
"type": "Redundancy",
"value": 6.85
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.195,2.023],
"number_observations_unique": 1579,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.888
},
{
"type": "R(meas)",
"value": 0.960
},
{
"type": "R(pim)",
"value": 0.359
},
{
"type": "I/SigI",
"value": 2.106
},
{
"type": "Completeness",
"value": 12.65
},
{
"type": "Redundancy",
"value": 6.77
},
{
"type": "CC(1/2)",
"value": 0.941
}
]
}
]
}