Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3abebd85c3cf2e8f1f0d52b111d4cac5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 166.430,
"b": 56.654,
"c": 73.685,
"alpha": 90.000,
"beta": 113.247,
"gamma": 90.000
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [200,2.30],
"number_observations_unique": 28028,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.44,2.30],
"number_observations_unique": 4412,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.131
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.652
}
]
}
]
}