Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5c14fa3309f1574276c5a8272852c1eb",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.063,
"b": 34.426,
"c": 69.548,
"alpha": 90.00,
"beta": 109.45,
"gamma": 90.00
},
"wavelengths": [0.97953],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.750,1.330],
"number_observations": 123621,
"number_observations_unique": 36064,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 30.200
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.330],
"number_observations_unique": 2514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.592
},
{
"type": "R(meas)",
"value": 0.703
},
{
"type": "R(pim)",
"value": 0.375
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.945
}
]
},
{
"resolution_limits": [26.750,5.950],
"number_observations_unique": 402,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(meas)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}