Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "104db6cb90ba87e771a56b7f7aacaec0",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.871,
"b": 88.871,
"c": 39.425,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.440,1.010],
"number_observations": 1026312,
"number_observations_unique": 161037,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 38148,
"number_observations_unique": 7662,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.895
},
{
"type": "R(meas)",
"value": 2.115
},
{
"type": "R(pim)",
"value": 0.923
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.397
}
]
},
{
"resolution_limits": [44.440,5.530],
"number_observations": 7277,
"number_observations_unique": 1069,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 29.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}