Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "846b1bb30ce39fff7ab6657687bffece",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.648,
"b": 40.029,
"c": 59.308,
"alpha": 90.00,
"beta": 93.41,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.030,1.600],
"number_observations_unique": 23138,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.600
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 3203,
"number_observations_unique": 1073,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.609
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 93.500
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [40.030,8.790],
"number_observations": 505,
"number_observations_unique": 158,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 21.000
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.200
}
]
}
]
}