Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "514b6ac6a8b9ae20469c4318ef55c6c5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 89.305,
"b": 53.322,
"c": 82.297,
"alpha": 90.00,
"beta": 95.31,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.730,1.450],
"number_observations": 760039,
"number_observations_unique": 64847,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 15.900
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"number_observations": 33013,
"number_observations_unique": 2991,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.722
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 89.800
},
{
"type": "Redundancy",
"value": 11.000
},
{
"type": "CC(1/2)",
"value": 0.645
}
]
},
{
"resolution_limits": [45.730,7.940],
"number_observations": 6311,
"number_observations_unique": 457,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 51.400
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}