Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5de4e3762d57c4cbedc99af49afa47ea",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 110.656,
"b": 180.962,
"c": 88.225,
"alpha": 90.00,
"beta": 106.42,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.56,1.74],
"number_observations": 628616,
"number_observations_unique": 166395,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.77,1.74],
"number_observations": 30547,
"number_observations_unique": 8269,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.084
},
{
"type": "R(meas)",
"value": 1.264
},
{
"type": "R(pim)",
"value": 0.642
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.473
}
]
}
]
}