Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "071d6f72f080698c8b94305f502ac84b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.812,
"b": 56.936,
"c": 64.969,
"alpha": 90.00,
"beta": 94.72,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.19,1.15],
"number_observations": 450690,
"number_observations_unique": 75823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 29.6
},
{
"type": "Completeness",
"value": 67.8
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 315,
"number_observations_unique": 270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.897
},
{
"type": "R(meas)",
"value": 1.268
},
{
"type": "R(pim)",
"value": 0.897
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 1.2
},
{
"type": "CC(1/2)",
"value": 0.496
}
]
}
]
}