Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "94c8728952f0fb6221b208684c5f664a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 181.106,
"b": 79.153,
"c": 59.103,
"alpha": 90.000,
"beta": 91.656,
"gamma": 90.000
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.52,2.45],
"number_observations_unique": 30851,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.368
},
{
"type": "R(meas)",
"value": 0.434
},
{
"type": "R(pim)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [90.52,8.83],
"number_observations_unique": 697,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.55,2.45],
"number_observations_unique": 3454,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.093
},
{
"type": "R(meas)",
"value": 3.731
},
{
"type": "R(pim)",
"value": 2.066
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.278
}
]
}
]
}