Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9c6319193916d921acba19bcb33396b5",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 74.121,
"b": 74.121,
"c": 175.467,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.230,1.550],
"number_observations": 451172,
"number_observations_unique": 79824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 17.900
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.550],
"number_observations": 16800,
"number_observations_unique": 3552,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.741
},
{
"type": "R(pim)",
"value": 0.360
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 88.600
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.783
}
]
},
{
"resolution_limits": [43.230,8.490],
"number_observations": 2921,
"number_observations_unique": 590,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 62.300
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}