Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9dfa5b87bb3004255334b3b8f20a96cf",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.169,
"b": 80.169,
"c": 139.648,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.930,1.570],
"number_observations": 726325,
"number_observations_unique": 38041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 26.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.610,1.570],
"number_observations": 50441,
"number_observations_unique": 2697,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.874
},
{
"type": "R(meas)",
"value": 0.899
},
{
"type": "R(pim)",
"value": 0.204
},
{
"type": "I/SigI",
"value": 3.500
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 18.700
},
{
"type": "CC(1/2)",
"value": 0.874
}
]
},
{
"resolution_limits": [27.930,7.000],
"number_observations": 9013,
"number_observations_unique": 526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 84.000
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 17.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}