Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "31de17a449e96c78af1e8a8944a35908",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 112.316,
"b": 112.316,
"c": 99.234,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.18,2.30],
"number_observations": 667923,
"number_observations_unique": 32535,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "R(meas)",
"value": 0.161
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 18.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 20.5
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.39,2.30],
"number_observations": 70780,
"number_observations_unique": 3353,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.266
},
{
"type": "R(meas)",
"value": 3.346
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 21.1
},
{
"type": "CC(1/2)",
"value": 0.631
}
]
}
]
}