Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ff73a7cee34993d54572b5e1d021fb92",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 63.051,
"b": 75.085,
"c": 118.880,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.478,1.98],
"number_observations_unique": 18931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.03364
},
{
"type": "R(meas)",
"value": 0.0386
},
{
"type": "R(pim)",
"value": 0.01841
},
{
"type": "I/SigI",
"value": 22.7
},
{
"type": "Completeness",
"value": 92.3
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.018,1.984],
"number_observations_unique": 957,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.263
},
{
"type": "R(meas)",
"value": 0.302
},
{
"type": "R(pim)",
"value": 0.146
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
{
"resolution_limits": [37.478,5.38],
"number_observations_unique": 1076,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.020
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}