Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9f92479e83f01683fdd02cca807df3a1",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 103.01,
"b": 103.01,
"c": 133.65,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.553,2.300],
"number_observations": 448717,
"number_observations_unique": 32281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0739
},
{
"type": "R(meas)",
"value": 0.0769
},
{
"type": "R(pim)",
"value": 0.0209
},
{
"type": "I/SigI",
"value": 24.34
},
{
"type": "Completeness",
"value": 98.45
},
{
"type": "Redundancy",
"value": 7.440
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.400,2.300],
"number_observations": 46203,
"number_observations_unique": 3195,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.8207
},
{
"type": "R(meas)",
"value": 0.851
},
{
"type": "R(pim)",
"value": 0.2234
},
{
"type": "I/SigI",
"value": 3.78
},
{
"type": "Completeness",
"value": 99.72
},
{
"type": "Redundancy",
"value": 7.614
},
{
"type": "CC(1/2)",
"value": 0.97
}
]
}
]
}