Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "56611766313d112328da1236243c63ab",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 77.223,
"b": 77.223,
"c": 71.785,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.600,1.400],
"number_observations": 469602,
"number_observations_unique": 43390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.400],
"number_observations": 42309,
"number_observations_unique": 6148,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.977
},
{
"type": "R(meas)",
"value": 2.141
},
{
"type": "R(pim)",
"value": 0.797
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.530
}
]
},
{
"resolution_limits": [54.600,4.420],
"number_observations": 18404,
"number_observations_unique": 1555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 72.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}