Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ede2fd421f2db419b2d8012508a180c3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 209.386,
"b": 113.888,
"c": 189.794,
"alpha": 90.00,
"beta": 90.54,
"gamma": 90.00
},
"wavelengths": [1.00003],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [104.688,1.958],
"number_observations": 1429316,
"number_observations_unique": 204303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 11.0
},
{
"type": "Completeness",
"value": 94.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.208,1.958],
"number_observations": 71002,
"number_observations_unique": 10215,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.127
},
{
"type": "R(pim)",
"value": 0.456
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.540
}
]
},
{
"resolution_limits": [104.688,6.207],
"number_observations": 67761,
"number_observations_unique": 10214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 27.7
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}