Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cbd4472290dc0028f6b01d6461b2f047",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.191,
"b": 65.448,
"c": 74.338,
"alpha": 90.000,
"beta": 112.899,
"gamma": 90.000
},
"wavelengths": [0.97926],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.51,1.45],
"number_observations_unique": 87656,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 16.4
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.45],
"number_observations_unique": 10648,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.430
},
{
"type": "R(meas)",
"value": 0.593
},
{
"type": "R(pim)",
"value": 0.406
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 80.6
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.608
}
]
}
]
}