Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "abc0ddc077fbe6cc34b146e31739d7d5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.409,
"b": 52.993,
"c": 44.259,
"alpha": 90.00,
"beta": 103.05,
"gamma": 90.00
},
"wavelengths": [0.91263],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.28,1.48],
"number_observations": 120667,
"number_observations_unique": 42355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.50,1.48],
"number_observations": 3893,
"number_observations_unique": 1953,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.093
},
{
"type": "R(meas)",
"value": 1.439
},
{
"type": "R(pim)",
"value": 0.926
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.253
}
]
}
]
}