Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "995041fb2741d6fff1d024d9f0052bb5",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 60.549,
"b": 91.936,
"c": 24.082,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.760,1.490],
"number_observations": 146167,
"number_observations_unique": 22778,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 23.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.490],
"number_observations": 10648,
"number_observations_unique": 1641,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.703
},
{
"type": "R(pim)",
"value": 0.295
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
},
{
"resolution_limits": [28.760,6.650],
"number_observations": 1768,
"number_observations_unique": 318,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 58.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}