Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e0636fe457290d4d8d0fb21d8cd20fe",
"space_group_name": "P 63",
"unit_cell": {
"a": 150.099,
"b": 150.099,
"c": 112.256,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91266],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [129.990,1.940],
"number_observations": 1063237,
"number_observations_unique": 105968,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.214
},
{
"type": "R(meas)",
"value": 0.226
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.970,1.940],
"number_observations": 46936,
"number_observations_unique": 5238,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.158
},
{
"type": "R(meas)",
"value": 3.351
},
{
"type": "R(pim)",
"value": 1.115
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 9.000
},
{
"type": "CC(1/2)",
"value": 0.337
}
]
},
{
"resolution_limits": [129.990,10.630],
"number_observations": 7375,
"number_observations_unique": 692,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}