Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d5945765e5e049fdabe6bac9b1d95bf7",
"space_group_name": "P 63",
"unit_cell": {
"a": 102.354,
"b": 102.354,
"c": 109.021,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54056],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.340,2.700],
"number_observations": 109336,
"number_observations_unique": 17802,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(pim)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.830,2.700],
"number_observations": 9508,
"number_observations_unique": 2372,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.421
},
{
"type": "R(pim)",
"value": 0.238
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.822
}
]
},
{
"resolution_limits": [19.340,8.960],
"number_observations": 4226,
"number_observations_unique": 456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 42.400
},
{
"type": "Completeness",
"value": 89.600
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}