Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a1fb10fc597df4c017f0f8ebe8444e09",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.030,
"b": 56.565,
"c": 64.424,
"alpha": 90.00,
"beta": 94.69,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.88,1.21],
"number_observations": 638574,
"number_observations_unique": 92281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.28,1.21],
"number_observations": 92457,
"number_observations_unique": 13486,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.143
},
{
"type": "R(meas)",
"value": 2.322
},
{
"type": "R(pim)",
"value": 0.883
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.399
}
]
}
]
}