Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13343603a6c8f7da8dc122ef11c20759",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 113.316,
"b": 113.316,
"c": 112.233,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.45867],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.96,3.2],
"number_observations_unique": 12568,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.41
},
{
"type": "R(meas)",
"value": 0.4181
},
{
"type": "R(pim)",
"value": 0.08148
},
{
"type": "I/SigI",
"value": 10.88
},
{
"type": "Completeness",
"value": 99.83
},
{
"type": "Redundancy",
"value": 25.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.314,3.2],
"number_observations_unique": 1223,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.331
},
{
"type": "R(meas)",
"value": 3.394
},
{
"type": "R(pim)",
"value": 0.6455
},
{
"type": "I/SigI",
"value": 1.27
},
{
"type": "Completeness",
"value": 99.92
},
{
"type": "Redundancy",
"value": 27.3
},
{
"type": "CC(1/2)",
"value": 0.544
}
]
}
]
}