Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c04e6cf4724184445cd810af2f4c3291",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.044,
"b": 53.522,
"c": 44.346,
"alpha": 90.00,
"beta": 100.83,
"gamma": 90.00
},
"wavelengths": [0.91261],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.29,1.29],
"number_observations": 166842,
"number_observations_unique": 56659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 86.0
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.31,1.29],
"number_observations": 2990,
"number_observations_unique": 1391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.914
},
{
"type": "R(meas)",
"value": 1.234
},
{
"type": "R(pim)",
"value": 0.819
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.066
}
]
}
]
}