Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4fb85a279f4b4eb06373b7c92c2b9b24",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 56.017,
"b": 33.504,
"c": 58.844,
"alpha": 90.000,
"beta": 117.253,
"gamma": 90.000
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.0,2.13],
"number_observations_unique": 5379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2174
},
{
"type": "R(meas)",
"value": 0.265
},
{
"type": "R(pim)",
"value": 0.1495
},
{
"type": "I/SigI",
"value": 3.82
},
{
"type": "Completeness",
"value": 96.67
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
},
"refln_shells": [
{
"resolution_limits": [2.21,2.13],
"number_observations_unique": 428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.9505
},
{
"type": "R(meas)",
"value": 1.178
},
{
"type": "R(pim)",
"value": 0.6867
},
{
"type": "I/SigI",
"value": 1.15
},
{
"type": "Completeness",
"value": 77.72
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.482
}
]
}
]
}