Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bb9dd58b45df1399e8baca10b9397c35",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.254,
"b": 34.866,
"c": 69.575,
"alpha": 90.00,
"beta": 108.63,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.780,1.370],
"number_observations": 116020,
"number_observations_unique": 34572,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 19.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.410,1.370],
"number_observations_unique": 2485,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.610
},
{
"type": "R(meas)",
"value": 0.729
},
{
"type": "R(pim)",
"value": 0.394
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.828
}
]
},
{
"resolution_limits": [28.780,6.130],
"number_observations_unique": 417,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(meas)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}