Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bca718bcdc3c77f3a055339875b0ae38",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.568,
"b": 57.375,
"c": 61.071,
"alpha": 90.000,
"beta": 111.004,
"gamma": 90.000
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.16],
"number_observations_unique": 15316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 15.20
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.9787
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.16],
"number_observations_unique": 1383,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.183
},
{
"type": "R(meas)",
"value": 0.233
},
{
"type": "R(pim)",
"value": 0.143
},
{
"type": "I/SigI",
"value": 2.95
},
{
"type": "Completeness",
"value": 89.5
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.930
}
]
}
]
}