Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "bbc8f04c597c7226ab94c834b0206a53",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.441,
"b": 51.452,
"c": 79.391,
"alpha": 90.0,
"beta": 92.2,
"gamma": 90.0
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.41,1.369],
"number_observations_unique": 75199,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 10.5
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.39,1.37],
"number_observations": 22632,
"number_observations_unique": 3400,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.068
},
{
"type": "R(meas)",
"value": 1.157
},
{
"type": "R(pim)",
"value": 0.440
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.671
}
]
}
]
}