Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cabb7b77b7bbb2d4566fad57ac2d2ba0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 69.958,
"b": 109.408,
"c": 78.568,
"alpha": 90.00,
"beta": 92.64,
"gamma": 90.00
},
"wavelengths": [0.93200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.010,3.100],
"number_observations": 113267,
"number_observations_unique": 21585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 10.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.310,3.100],
"number_observations": 20824,
"number_observations_unique": 3902,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.913
},
{
"type": "R(pim)",
"value": 0.437
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.712
}
]
},
{
"resolution_limits": [48.010,8.770],
"number_observations": 4723,
"number_observations_unique": 980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 34.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}