Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "892ff563ce9bda3953c5e26e51ace532",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 182.553,
"b": 59.300,
"c": 67.368,
"alpha": 90.00,
"beta": 94.82,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.000,1.180],
"number_observations": 2151280,
"number_observations_unique": 231646,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 14.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.240,1.180],
"number_observations": 252941,
"number_observations_unique": 32187,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.872
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 7.900
},
{
"type": "CC(1/2)",
"value": 0.778
}
]
},
{
"resolution_limits": [40.000,3.730],
"number_observations": 64330,
"number_observations_unique": 7527,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 39.600
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}