Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4dd0a6f67a8a8b16619bc9796931090b",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 209.560,
"b": 209.560,
"c": 343.348,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.740,3.500],
"number_observations": 296628,
"number_observations_unique": 55066,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.197
},
{
"type": "R(meas)",
"value": 0.219
},
{
"type": "R(pim)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
},
"refln_shells": [
{
"resolution_limits": [3.600,3.500],
"number_observations": 24627,
"number_observations_unique": 4491,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.874
},
{
"type": "R(meas)",
"value": 0.966
},
{
"type": "R(pim)",
"value": 0.396
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.543
}
]
},
{
"resolution_limits": [90.740,14.850],
"number_observations": 3954,
"number_observations_unique": 832,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 21.000
},
{
"type": "Completeness",
"value": 93.100
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.960
}
]
}
]
}