Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9d9fdd1dfe1a3ef023b9ebaf67c5c9c2",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 54.484,
"b": 82.471,
"c": 86.941,
"alpha": 90.000,
"beta": 96.628,
"gamma": 90.000
},
"wavelengths": [1.54301],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.51,2.1],
"number_observations_unique": 21033,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.06665
},
{
"type": "R(meas)",
"value": 0.07304
},
{
"type": "R(pim)",
"value": 0.02877
},
{
"type": "I/SigI",
"value": 15.61
},
{
"type": "Completeness",
"value": 94.05
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.175,2.1],
"number_observations_unique": 1981,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1772
},
{
"type": "R(meas)",
"value": 0.2115
},
{
"type": "R(pim)",
"value": 0.1129
},
{
"type": "I/SigI",
"value": 5.51
},
{
"type": "CC(1/2)",
"value": 0.973
}
]
}
]
}