Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bd5c49664da9308e0447fd85958b76c2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.652,
"b": 67.949,
"c": 40.398,
"alpha": 90.00,
"beta": 93.46,
"gamma": 90.00
},
"wavelengths": [1.07180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.32,1.20],
"number_observations_unique": 60761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 28.5
},
{
"type": "Completeness",
"value": 91.1
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 1738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 52.9
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
}
]
}