Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c89fdb995979c7a5f06f01c06d19fd30",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 38.920,
"b": 45.143,
"c": 82.443,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.69830],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.2,1.27],
"number_observations_unique": 38867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 19.7
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.29,1.27],
"number_observations_unique": 1722,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 90.8
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}