Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f1186124b54e0e37b1956de0a3cbb2b0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.102,
"b": 41.323,
"c": 72.130,
"alpha": 90.00,
"beta": 104.19,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.320,1.280],
"number_observations": 204824,
"number_observations_unique": 58025,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 10.400
},
{
"type": "Completeness",
"value": 92.800
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.300,1.280],
"number_observations_unique": 2345,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.103
},
{
"type": "R(meas)",
"value": 1.327
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "Completeness",
"value": 76.900
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.436
}
]
},
{
"resolution_limits": [41.320,6.990],
"number_observations_unique": 393,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}