Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b71eb26bad721c479f3cdaf9b70df38c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 89.236,
"b": 59.722,
"c": 32.714,
"alpha": 90.00,
"beta": 90.35,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.62,1.34],
"number_observations": 224485,
"number_observations_unique": 38012,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.34],
"number_observations": 17901,
"number_observations_unique": 5033,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.101
},
{
"type": "R(meas)",
"value": 1.295
},
{
"type": "R(pim)",
"value": 0.662
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.449
}
]
}
]
}