Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ca24f28381c2af51ea0f18b1738c9f81",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 68.011,
"b": 68.011,
"c": 102.279,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.140,1.020],
"number_observations": 197769,
"number_observations_unique": 104707,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.800
},
{
"type": "Completeness",
"value": 85.800
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.040,1.020],
"number_observations": 1576,
"number_observations_unique": 1269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.497
},
{
"type": "R(meas)",
"value": 0.703
},
{
"type": "R(pim)",
"value": 0.497
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 21.700
},
{
"type": "Redundancy",
"value": 1.200
},
{
"type": "CC(1/2)",
"value": 0.553
}
]
},
{
"resolution_limits": [51.140,5.590],
"number_observations": 1439,
"number_observations_unique": 897,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.011
},
{
"type": "R(meas)",
"value": 0.015
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 27.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}