Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4b32b221e658bb6756bbbd9d0d80af9e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 120.590,
"b": 60.775,
"c": 75.654,
"alpha": 90.00,
"beta": 121.56,
"gamma": 90.00
},
"wavelengths": [0.97940],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.18,1.906],
"number_observations_unique": 35304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.01955
},
{
"type": "I/SigI",
"value": 10.17
},
{
"type": "Completeness",
"value": 96.04
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.974,1.906],
"number_observations_unique": 2927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5925
},
{
"type": "I/SigI",
"value": 1.16
},
{
"type": "Completeness",
"value": 77.40
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.702
}
]
}
]
}