Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d28f591d235460a574ea7f769d9ed03b",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 49.056,
"b": 49.056,
"c": 196.830,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.48,1.70],
"number_observations_unique": 31151,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 18.8
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 10.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [42.48,9.00],
"number_observations_unique": 285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 53.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 8.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.73,1.70],
"number_observations_unique": 1452,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.406
},
{
"type": "R(meas)",
"value": 1.667
},
{
"type": "R(pim)",
"value": 0.871
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 90.2
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.407
}
]
}
]
}