Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f41753ffb5fb2a6a1289c5aa63f06d2b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 80.140,
"b": 114.833,
"c": 155.211,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.171,2.98],
"number_observations_unique": 29952,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.202
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [3.14,2.98],
"number_observations_unique": 4290,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.416
},
{
"type": "R(pim)",
"value": 0.572
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.565
}
]
}
]
}