Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8f2646d98c02a86bb95b7b4cd3a63a50",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.704,
"b": 88.704,
"c": 39.557,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.350,1.020],
"number_observations": 1001201,
"number_observations_unique": 156284,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 11.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.040,1.020],
"number_observations": 42560,
"number_observations_unique": 7577,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.967
},
{
"type": "R(meas)",
"value": 2.170
},
{
"type": "R(pim)",
"value": 0.897
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.454
}
]
},
{
"resolution_limits": [44.350,5.590],
"number_observations": 7075,
"number_observations_unique": 1038,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 45.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}