Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "716e3dd00f517619a5099c8bfece9f76",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 24.42,
"b": 45.12,
"c": 45.45,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.020,1.130],
"number_observations": 131157,
"number_observations_unique": 19277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 17.100
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.150,1.130],
"number_observations": 6485,
"number_observations_unique": 986,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.378
},
{
"type": "R(pim)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.905
}
]
},
{
"resolution_limits": [32.020,6.080],
"number_observations": 447,
"number_observations_unique": 105,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 24.800
},
{
"type": "Completeness",
"value": 65.400
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}