Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f2e239e6abe560491e4ee9a8a4df2795",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 103.747,
"b": 79.859,
"c": 68.567,
"alpha": 90.000,
"beta": 130.474,
"gamma": 90.000
},
"wavelengths": [0.92820],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.02,1.42],
"number_observations_unique": 78799,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.02781
},
{
"type": "R(meas)",
"value": 0.03933
},
{
"type": "R(pim)",
"value": 0.02781
},
{
"type": "I/SigI",
"value": 17.16
},
{
"type": "Completeness",
"value": 98.65
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.472,1.421],
"number_observations_unique": 7572,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3267
},
{
"type": "R(meas)",
"value": 0.4621
},
{
"type": "R(pim)",
"value": 0.3267
},
{
"type": "I/SigI",
"value": 2.11
},
{
"type": "Completeness",
"value": 95.51
},
{
"type": "Redundancy",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.743
}
]
}
]
}