Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b26bca8841e01f46d878e24f1305a1ad",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 79.380,
"b": 102.770,
"c": 89.068,
"alpha": 90.000,
"beta": 107.984,
"gamma": 90.000
},
"wavelengths": [0.97852],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.65],
"number_observations_unique": 39566,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.79,2.65],
"number_observations_unique": 5746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.779
},
{
"type": "R(meas)",
"value": 0.872
},
{
"type": "R(pim)",
"value": 0.383
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.785
}
]
}
]
}