Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "af954db1d032e8eecc47a63f0522141c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.433,
"b": 67.883,
"c": 40.202,
"alpha": 90.00,
"beta": 93.29,
"gamma": 90.00
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.55,1.40],
"number_observations_unique": 41660,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 16.1
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations_unique": 2024,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.650
},
{
"type": "R(pim)",
"value": 0.706
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.779
}
]
}
]
}