Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "23ac6d84c1386217f917de30fa448e2a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 112.685,
"b": 59.200,
"c": 114.937,
"alpha": 90.0,
"beta": 91.3,
"gamma": 90.0
},
"wavelengths": [0.95000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.870,1.830],
"number_observations": 935212,
"number_observations_unique": 132141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 18.200
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.830],
"number_observations": 45321,
"number_observations_unique": 6338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.459
},
{
"type": "R(meas)",
"value": 0.494
},
{
"type": "R(pim)",
"value": 0.182
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.914
}
]
},
{
"resolution_limits": [47.870,10.020],
"number_observations": 5934,
"number_observations_unique": 880,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "R(meas)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 58.300
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}