Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cde39378861446e195c108672ad18980",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 90.06,
"b": 90.06,
"c": 98.12,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.93,2.17],
"number_observations_unique": 23157,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 13.3
},
{
"type": "Completeness",
"value": 93.1
},
{
"type": "Redundancy",
"value": 11.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [40.93,8.95],
"number_observations_unique": 400,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 38.5
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 10.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.24,2.17],
"number_observations_unique": 1624,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.735
},
{
"type": "R(meas)",
"value": 5.210
},
{
"type": "R(pim)",
"value": 2.151
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 76.4
},
{
"type": "Redundancy",
"value": 11.2
},
{
"type": "CC(1/2)",
"value": 0.532
}
]
}
]
}