Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fe8c815c6131580d468dbc9fa8e57f5a",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.79,
"b": 80.79,
"c": 140.36,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.180,1.400],
"number_observations": 942774,
"number_observations_unique": 53979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 24.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.440,1.400],
"number_observations": 47745,
"number_observations_unique": 3908,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.034
},
{
"type": "R(meas)",
"value": 2.124
},
{
"type": "R(pim)",
"value": 0.603
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.471
}
]
},
{
"resolution_limits": [70.180,6.260],
"number_observations": 11869,
"number_observations_unique": 746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 100.900
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 15.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}