Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c4c55fe31092c6e2e8884eabdb45b0b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.764,
"b": 68.410,
"c": 79.298,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.80,1.14],
"number_observations_unique": 89827,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 90.9
},
{
"type": "Redundancy",
"value": 12.6
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.21,1.14],
"number_observations_unique": 8062,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.703
},
{
"type": "R(meas)",
"value": 1.814
},
{
"type": "R(pim)",
"value": 0.601
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 57.1
},
{
"type": "Redundancy",
"value": 8.5
},
{
"type": "CC(1/2)",
"value": 0.579
}
]
}
]
}