Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b9cb3e1ef9e5a7b4b39754b13eec90bb",
"space_group_name": "C 2 2 2",
"unit_cell": {
"a": 117.89,
"b": 171.80,
"c": 105.34,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.32,3.20],
"number_observations_unique": 18019,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "R(meas)",
"value": 0.178
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 10.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [46.27,9.05],
"number_observations_unique": 874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 8.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [3.42,3.20],
"number_observations_unique": 3207,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.276
},
{
"type": "R(meas)",
"value": 1.417
},
{
"type": "R(pim)",
"value": 0.606
},
{
"type": "Redundancy",
"value": 9.7
},
{
"type": "CC(1/2)",
"value": 0.802
}
]
}
]
}