Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "57a6142bd5e674687fc3e39d08deff7a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.67,
"b": 42.62,
"c": 86.44,
"alpha": 90.00,
"beta": 122.07,
"gamma": 90.00
},
"wavelengths": [0.99987],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.315,1.965],
"number_observations": 119240,
"number_observations_unique": 23793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.157
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.999,1.965],
"number_observations_unique": 1178,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.632
},
{
"type": "R(pim)",
"value": 0.838
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.403
}
]
}
]
}