Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e2f61b1aeb876a56446e45ee84debb2c",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 99.808,
"b": 99.808,
"c": 143.061,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.670,2.100],
"number_observations": 101431,
"number_observations_unique": 41687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 6639,
"number_observations_unique": 3267,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.607
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.622
}
]
},
{
"resolution_limits": [47.670,8.910],
"number_observations": 1338,
"number_observations_unique": 527,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 38.900
},
{
"type": "Completeness",
"value": 84.900
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}