Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4bffc2621b9c4a39f905039a3a146d92",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 147.044,
"b": 354.390,
"c": 217.463,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97852],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.500,2.900],
"number_observations_unique": 120224,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.228
},
{
"type": "R(meas)",
"value": 0.249
},
{
"type": "R(pim)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 9.500
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
"refln_shells": [
{
"resolution_limits": [2.950,2.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.933
},
{
"type": "R(meas)",
"value": 2.110
},
{
"type": "R(pim)",
"value": 0.821
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.310
}
]
},
{
"resolution_limits": [48.550,15.880],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Completeness",
"value": 91.000
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}