Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0cb8a90540ca3e689b41f3e0a2f6832a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 78.762,
"b": 78.762,
"c": 36.928,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.6900,1.480],
"number_observations_unique": 19993,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 20.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.500,1.480],
"number_observations_unique": 959,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.079
},
{
"type": "R(meas)",
"value": 3.232
},
{
"type": "R(pim)",
"value": 0.965
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.303
}
]
},
{
"resolution_limits": [39.380,8.100],
"number_observations_unique": 166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}