Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2a28779f230ae71702f0fb903df706bb",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 169.351,
"b": 169.351,
"c": 52.629,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.12708],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,1.78],
"number_observations_unique": 81048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 20.8
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.78],
"number_observations_unique": 3493,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.156
},
{
"type": "R(meas)",
"value": 1.269
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 84.2
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.560
}
]
}
]
}