Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "61702e01c9fb06dadf314fa2c446b73a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 87.710,
"b": 60.724,
"c": 84.106,
"alpha": 90.00,
"beta": 113.96,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.40,2.58],
"number_observations_unique": 12207,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.199
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.967
}
]
},
"refln_shells": [
{
"resolution_limits": [2.68,2.58],
"number_observations_unique": 814,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.609
},
{
"type": "R(pim)",
"value": 0.444
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.702
}
]
}
]
}