Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6447ff44bdfaeeee3baac8ab8e021b46",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 74.342,
"b": 74.342,
"c": 174.898,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.720,1.750],
"number_observations": 247205,
"number_observations_unique": 57234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 9.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.780,1.750],
"number_observations": 11607,
"number_observations_unique": 3088,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.563
},
{
"type": "R(pim)",
"value": 0.332
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.767
}
]
},
{
"resolution_limits": [43.720,9.090],
"number_observations": 1991,
"number_observations_unique": 487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 22.700
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}