Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d81f9f26ad2abc171776e77dd781ca39",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.809,
"b": 62.789,
"c": 147.786,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.76,1.25],
"number_observations": 1100350,
"number_observations_unique": 101816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 14.3
},
{
"type": "Completeness",
"value": 91.9
},
{
"type": "Redundancy",
"value": 10.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.27,1.25],
"number_observations": 10809,
"number_observations_unique": 2806,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.469
},
{
"type": "R(meas)",
"value": 1.699
},
{
"type": "R(pim)",
"value": 0.835
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.328
}
]
}
]
}