Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ceb1a51b23e14cf95fab9d74456059b6",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 60.141,
"b": 60.141,
"c": 109.994,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.010,1.740],
"number_observations": 270320,
"number_observations_unique": 21501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.124
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 10.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.790,1.740],
"number_observations": 20224,
"number_observations_unique": 1542,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.283
},
{
"type": "R(meas)",
"value": 2.375
},
{
"type": "R(pim)",
"value": 0.651
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.799
}
]
},
{
"resolution_limits": [55.010,7.780],
"number_observations": 3256,
"number_observations_unique": 311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 27.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.964
}
]
}
]
}