Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5e2ba059e786457fe470764e8c64232e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.460,
"b": 45.971,
"c": 90.156,
"alpha": 90.0,
"beta": 129.3,
"gamma": 90.0
},
"wavelengths": [0.77490],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.32,0.99],
"number_observations": 1488111,
"number_observations_unique": 217930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 14.8
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.02,0.99],
"number_observations": 141992,
"number_observations_unique": 20381,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.346
},
{
"type": "R(meas)",
"value": 2.532
},
{
"type": "R(pim)",
"value": 0.944
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.364
}
]
}
]
}