Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d3dcab2d81bcd8bf439dc957acc2f4ea",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 36.416,
"b": 37.601,
"c": 97.117,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.80000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.56,1.15],
"number_observations": 165902,
"number_observations_unique": 47379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 7250,
"number_observations_unique": 2270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "R(meas)",
"value": 0.206
},
{
"type": "R(pim)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.922
}
]
}
]
}