Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "fa0f1aa29797b4cd4d485f094e248577",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 158.163,
"b": 68.890,
"c": 227.711,
"alpha": 90.00,
"beta": 104.61,
"gamma": 90.00
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [220.347,2.235],
"number_observations_unique": 81602,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "R(meas)",
"value": 0.170
},
{
"type": "R(pim)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 89.6
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.470,2.235],
"number_observations_unique": 4080,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.124
},
{
"type": "R(meas)",
"value": 1.336
},
{
"type": "R(pim)",
"value": 0.716
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 41.1
},
{
"type": "Redundancy",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.420
}
]
}
]
}