Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9509e10b5613cf2aad022303f072f634",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.360,
"b": 57.132,
"c": 65.951,
"alpha": 90.000,
"beta": 98.528,
"gamma": 90.000
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.78,1.30],
"number_observations_unique": 91883,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 8.3
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 11.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.30],
"number_observations_unique": 3497,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.113
},
{
"type": "R(pim)",
"value": 0.542
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 75.3
},
{
"type": "Redundancy",
"value": 5
},
{
"type": "CC(1/2)",
"value": 0.577
}
]
}
]
}