Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b42b193a2f86544867127a9df9bc2abf",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.582,
"b": 42.582,
"c": 217.035,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.64,1.37],
"number_observations": 999537,
"number_observations_unique": 43592,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 19.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 22.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.39,1.37],
"number_observations": 29112,
"number_observations_unique": 2048,
"quality_factors": [
{
"type": "R(merge)",
"value": 6.945
},
{
"type": "R(meas)",
"value": 7.203
},
{
"type": "R(pim)",
"value": 1.885
},
{
"type": "I/SigI",
"value": 0.1
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.408
}
]
}
]
}