Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "526e38185ecc59b71e403118fdac07a9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.23,
"b": 33.02,
"c": 72.71,
"alpha": 90.000,
"beta": 90.161,
"gamma": 90.000
},
"wavelengths": [0.96000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.710,1.268],
"number_observations_unique": 58090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 91.3
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.290,1.268],
"number_observations_unique": 2507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.664
},
{
"type": "R(meas)",
"value": 0.761
},
{
"type": "R(pim)",
"value": 0.365
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 79.8
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.828
}
]
}
]
}