Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bf402c3073bfeae16f6ecbc249bab6ef",
"space_group_name": "P 42 2 2",
"unit_cell": {
"a": 91.970,
"b": 91.970,
"c": 176.915,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.51,2.1],
"number_observations_unique": 45137,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2715
},
{
"type": "R(meas)",
"value": 0.2818
},
{
"type": "R(pim)",
"value": 0.07507
},
{
"type": "I/SigI",
"value": 11.90
},
{
"type": "Completeness",
"value": 99.76
},
{
"type": "Redundancy",
"value": 13.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.175,2.1],
"number_observations_unique": 4370,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.938
},
{
"type": "R(meas)",
"value": 3.049
},
{
"type": "R(pim)",
"value": 0.8113
},
{
"type": "Completeness",
"value": 99.36
},
{
"type": "Redundancy",
"value": 14.0
},
{
"type": "CC(1/2)",
"value": 0.434
}
]
}
]
}