Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f81e86020c2c59c178fdc24d3e7773b2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.537,
"b": 52.886,
"c": 44.718,
"alpha": 90.000,
"beta": 102.766,
"gamma": 90.000
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.88,1.68],
"number_observations_unique": 28421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.71,1.68],
"number_observations_unique": 1371,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.606
},
{
"type": "R(meas)",
"value": 0.718
},
{
"type": "R(pim)",
"value": 0.378
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 93.3
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.566
}
]
}
]
}