Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5c1d49d76cc4779e3bcc084e737e7c6f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.767,
"b": 61.193,
"c": 44.774,
"alpha": 90.000,
"beta": 117.283,
"gamma": 90.000
},
"wavelengths": [0.92010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.26,1.39],
"number_observations_unique": 41218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 12.30
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.43,1.39],
"number_observations_unique": 2998,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.566
},
{
"type": "I/SigI",
"value": 2.10
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.828
}
]
}
]
}