Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "67063b13037b4066c23bade1a7688a39",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 79.280,
"b": 159.902,
"c": 97.394,
"alpha": 90.00,
"beta": 90.21,
"gamma": 90.00
},
"wavelengths": [1.07500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [159.902,2.902],
"number_observations": 300496,
"number_observations_unique": 53085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.912,2.902],
"number_observations": 3187,
"number_observations_unique": 550,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.807
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.800
}
]
},
{
"resolution_limits": [159.902,13.469],
"number_observations": 2923,
"number_observations_unique": 549,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 5.300
}
]
}
]
}