Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f0f7c4f2b35ae790c33f0d08545fe8a7",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 78.141,
"b": 95.799,
"c": 144.972,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.320,2.850],
"number_observations": 110916,
"number_observations_unique": 25898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 11.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.9048,2.850],
"number_observations": 16790,
"number_observations_unique": 3759,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.72700
},
{
"type": "R(pim)",
"value": 0.383
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.781
}
]
},
{
"resolution_limits": [48.320,9.010],
"number_observations": 3289,
"number_observations_unique": 900,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 32.900
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}