Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "925a3df1f7545810c2b665fc48e27f53",
"space_group_name": "I 4 2 2",
"unit_cell": {
"a": 88.971,
"b": 88.971,
"c": 133.396,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.02,2.55],
"number_observations_unique": 8461,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 94.6
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.66,2.55],
"number_observations_unique": 1001,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.817
},
{
"type": "R(meas)",
"value": 0.913
},
{
"type": "R(pim)",
"value": 0.400
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 95.6
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.758
}
]
}
]
}