Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5b1ff77942c142983caf726703bb3411",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 60.526,
"b": 53.341,
"c": 64.760,
"alpha": 90.00,
"beta": 102.74,
"gamma": 90.00
},
"wavelengths": [1.60832],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.16,2.27],
"number_observations_unique": 18764,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 13.6
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [63.16,9.06],
"number_observations_unique": 329,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 29.5
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [2.34,2.27],
"number_observations_unique": 1722,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.404
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.852
}
]
}
]
}